AG01BEUU

Name: N-(3-acetylphenyl)-15-amino-4,7-dioxa-13-thia-11-azatetracyclo[8.7.0.0^{3,8}.0^{12,16}]heptadeca-1(17),2,8,10,12(16),14-hexaene-14-carboxamide
Brand: Angene Chemical
SKU: AG01BEUU

602293-00-5 | N-(3-acetylphenyl)-15-amino-4,7-dioxa-13-thia-11-azatetracyclo[8.7.0.0^{3,8}.0^{12,16}]heptadeca-1(17),2,8,10,12(16),14-hexaene-14-carboxamide

$Chemical structure of N-(3-acetylphenyl)-15-amino-4,7-dioxa-13-thia-11-azatetracyclo[8.7.0.0^{3,8}.0^{12,16}]heptadeca-1(17),2,8,10,12(16),14-hexaene-14-carboxamide, CAS 602293-00-5$

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CAS Number	602293-00-5
Catalog Number	AG01BEUU
Chemical Name	N-(3-acetylphenyl)-15-amino-4,7-dioxa-13-thia-11-azatetracyclo[8.7.0.0^{3,8}.0^{12,16}]heptadeca-1(17),2,8,10,12(16),14-hexaene-14-carboxamide
IUPAC Name	N-(3-acetylphenyl)-15-amino-4,7-dioxa-13-thia-11-azatetracyclo[8.7.0.03,8.012,16]heptadeca-1(17),2,8,10,12(16),14-hexaene-14-carboxamide
InChI	InChI=1S/C22H17N3O4S/c1-11(26)12-3-2-4-14(7-12)24-21(27)20-19(23)15-8-13-9-17-18(29-6-5-28-17)10-16(13)25-22(15)30-20/h2-4,7-10H,5-6,23H2,1H3,(H,24,27)
InChI Key	IIAMBYTZHAPBQC-UHFFFAOYSA-N
MDL Number	MFCD03823252
Molecular Formula	C22H17N3O4S
Molecular Weight	419.4531
SMILES	CC(C1=CC(NC(C2=C(N)C3=C(N=C4C(=C3)C=C3C(OCCO3)=C4)S2)=O)=CC=C1)=O
Synonyms	CHEMBL3261343, 602293-00-5, AC1MKOQL, ASN 05545158, SCHEMBL16335272, BDBM50012919, ZINC13503459, AKOS000708486, MCULE-7915046393, SR-01000341598, SR-01000341598-1, N-(3-acetylphenyl)-15-amino-4,7-dioxa-13-thia-11-azatetracyclo[8.7.0.0^{3,8}.0^{12,16}]heptadeca-1,3(8),9,11,14,16-hexaene-14-carboxamide, N-(3-Acetylphenyl)-9-amino-2,3-dihydro-1,4-dioxino[2,3-g]thieno[2,3-b]quinoline-8-carboxamide, CID3207458,

Complexity	679
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	419.094g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	419.455g/mol
Monoisotopic Mass	419.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	132A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited