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AG001WYP

Name: 1-PROPANAMINE, 3-DIBENZ[B,E]OXEPIN-11(6H)-YLIDENE-N,N-DIMETHYL-
Brand: Angene Chemical
SKU: AG001WYP

1668-19-5 | 1-PROPANAMINE, 3-DIBENZ[B,E]OXEPIN-11(6H)-YLIDENE-N,N-DIMETHYL-

Chemical structure of 1-PROPANAMINE, 3-DIBENZ[B,E]OXEPIN-11(6H)-YLIDENE-N,N-DIMETHYL-, CAS 1668-19-5

AG001WYP

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CAS Number	1668-19-5
Catalog Number	AG001WYP(AGN-PC-0A3SF7)
Chemical Name	1-PROPANAMINE, 3-DIBENZ[B,E]OXEPIN-11(6H)-YLIDENE-N,N-DIMETHYL-
IUPAC Name	(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine
InChI	InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11+
InChI Key	ODQWQRRAPPTVAG-GZTJUZNOSA-N
MDL Number	MFCD00837217
Molecular Formula	C19H21NO
Molecular Weight	279.3761
SMILES	CN(C)CCC=C1C2=CC=CC=C2OCC3=CC=CC=C13
UNII	851NLB57HQ
Synonyms	Apo Doxepin, Apo-Doxepin, ApoDoxepin, Aponal, Deptran, Desidox, Doneurin, Doxepia, Doxepin, Doxepin beta, Doxepin Hydrochloride, Doxepin Hydrochloride, Cis-Trans Isomer Mixture (approximately 1:5), Doxepin RPh, Doxepin-RPh, Espadox, Hydrochloride, Doxepin, Mareen, Novo Doxepin, Novo-Doxepin, Prudoxin, Quitaxon, Sinequan, Sinquan, Xepin, Zonalon, doxepin, Doxepine, Doxepinum [INN-Latin], Doxepina [INN-Spanish], Doxepin [USAN], Zonalon, trans-doxepin, (e)-doxepin, Quitaxon, 1668-19-5, MF 10, UNII-851NLB57HQ, Sinequan, CCRIS 9176, HSDB 3069, Sinequan (TN), Cidoxepina, Cidoxepinum, 11-(3-(Dimethylamino)propylidene)-6H-dibenz(b,e)oxepine, 851NLB57HQ, 11-(3-Dimethylaminopropylidene)-6,11-dihydrodibenz(b,e)oxipin, 11-(3-Dimethylamino-propyliden)-6,11-dihydro-dibenz(b,e)oxipin, N,N-Dimethyldibenz(b,e)oxepin-delta(11(6H),gamma)-propylamine, Cidoxepin [INN], Curatin, Adapin, Doxepina, Doxepinum, (3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine, 3607-34-9, C19H21NO, Deptran, Triadapin, 1-Propanamine, 3-dibenz(b,e)oxepin-11(6H)-ylidene-N,N-dimethyl-, Dibenz(b,e)oxepin-delta(sup 11(6H)),gamma-propylamine, N,N-dimethyl-, (3e)-3-(Dibenzo[b,E]oxepin-11(6h)-Ylidene)-N,N-Dimethylpropan-1-Amine, Doxepin (INN), [11C]doxepin, [11C]-doxepin, Doxepin, (E)-, Doxepin, Hydrochloride, Doxepin [INN:BAN], NCGC00015344-03, CAS-1229-29-4, cis-N-(3-(6H-Dibenz(b,e)oxepin-11-yliden)propyl)-N,N-dimethylamin, Sinequan, Zonalon, Doxepin Hydrochloride,, E-DOXEPIN, Tocris-0508, Prestwick2_000263, Prestwick3_000263, Lopac-D-4526, CHEMBL860, AC1LDI63, Lopac0_000339, BSPBio_000106, SCHEMBL116895, BPBio1_000118, GTPL1225, GTPL3958, ZINC1331, DTXSID7022966, BDBM112780, AKOS016014904, CCG-204434, NCGC00015344-01, NCGC00015344-02, NCGC00015344-04, NCGC00024623-01, NCGC00162127-01, AJ-08007, BC225584, LS-61638, US8629135, SW-07, AX8126881, LS-174582, C06971, D07875, L000699, BRD-K36616567-003-01-5, BRD-K54462405-003-03-3, BRD-K54462405-003-16-5, UNII-5ASJ6HUZ7D component ODQWQRRAPPTVAG-GZTJUZNOSA-N, (E)-3-(Dibenzo[b,e]oxepin-11(6H)-ylidene)-N,N-dimethylpropan-1-amine, 5EH, dimethyl({3-[(2E)-9-oxatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene]propyl})amine, dimethyl(3-{9-oxatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene}propyl)amine, Cidoxepin, Aponal, Doxepin Hydrochloride, Doneurin, Prudoxin, Desidox, Doxepia, Espadox, Silenor, Sinquan, Mareen, ApoDoxepin, Xepin, cis-doxepin, Doxepin beta, Novo Doxepin, Novo-Doxepin, Apo Doxepin, Apo-Doxepin, Doxepin HCl, Doxepin RPh, Doxepin-RPh, (Z)-Doxepin, Adapine (TN), Deptran (TN), Sinquan (TN), Zonalon (TN), Aponal (TN), Doxepin (Z)-isomer, Xepin (TN), Hydrochloride, Doxepin, UNII-5ASJ6HUZ7D, 5ASJ6HUZ7D, D06EUH, D06FES, MOLI001594, C19-H21-N-O, CID667477, P-3693A, D004316, 3-Dibenz[b,e]oxepin-11(6H)-ylidene-N,N-dimethyl-1-propanamine, 3-(Dibenzo[b,e]oxepin-11(6H)-ylidene)-N,N-dimethylpropan-1-amine, N,N-dimethyldibenz[b,e]-oxepin-delta-11(6H),gamma-propylamine, 1-Propanamine, 3-dibenz[b,e]oxepin-11(6H)-ylidene-N,N-dimethyl-, 3-dibenzo[b,e]oxepin-11(6H)-ylidene-N,N-dimethylpropan-1-amine, Dibenz(b,e)oxepin-delta(11(6H),gamma)-propylamine, N,N-dimethyl-, Doxepin Hydrochloride, Cis-Trans Isomer Mixture (approximately 1:5), (3E)-3-dibenzo[b,e]oxepin-11(6H)-ylidene-N,N-dimethylpropan-1-amine, (3Z)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine, (3Z)-3-dibenzo[b,e]oxepin-11(6H)-ylidene-N,N-dimethylpropan-1-amine, 3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine, Dibenz[b,e]oxepin-.delta.11(6H),.gamma.-propylamine, N,N-dimethyl-, (3Z)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-di(methyl)propan-1-amine,

Complexity	363
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	279.162g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	279.383g/mol
Monoisotopic Mass	279.162g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	12.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.3

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

Date:

Angene International Limited

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