AG00145W

133059-99-1 | 4-Pyrimidinamine, N-ethyl-1,6-dihydro-1,2-dimethyl-6-(methylimino)-N-phenyl-, hydrochloride (1:1)

AG00145W

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CAS Number	133059-99-1
Catalog Number	AG00145W(AGN-PC-0JLOO0)
Chemical Name	4-Pyrimidinamine, N-ethyl-1,6-dihydro-1,2-dimethyl-6-(methylimino)-N-phenyl-, hydrochloride (1:1)
IUPAC Name	N-ethyl-1,2-dimethyl-6-methylimino-N-phenylpyrimidin-4-amine;hydrochloride
InChI	InChI=1S/C15H20N4.ClH/c1-5-19(13-9-7-6-8-10-13)15-11-14(16-3)18(4)12(2)17-15;/h6-11H,5H2,1-4H3;1H
InChI Key	DUWKUHWHTPRMAP-UHFFFAOYSA-N
MDL Number	MFCD00914937
Molecular Formula	C15H21ClN4
Molecular Weight	292.8070
SMILES	C/N=C1C=C(N(CC)C2=CC=CC=C2)N=C(C)N/1C.[H]Cl
Synonyms	4-(N-ethyl-N-phenylamino)-1,2-dimethyl-6-(methylamino)pyrimidinium chloride, ICI D2788, ICI-D2788, ZD 7288, ZD-7288, ZD7288, ZENECA ZD7288, ZD 7288, 133059-99-1, Zeneca ZD7288, ZD7288, Ici-D2788, ICI D2788, 4-(N-Ethyl-N-phenylamino)-1,2-dimethyl-6-(methylamino)pyrimidinium chloride, N-Ethyl-1,6-dihydro-1,2-dimethyl-6-(methylimino)-N-phenyl-4-pyrimidinamine monohydrochloride, 4-Pyrimidinamine, N-ethyl-1,6-dihydro-1,2-dimethyl-6-(methylimino)-N-phenyl-, monohydrochloride, N-Ethyl-1,6-dihydro-1,2-dimethyl-6-(methylimino)-N-phenyl-4-pyrimidinamine hydrochloride, AC1L3XOA, C15H20N4.HCl, SCHEMBL6802125, CTK8E7951, INB0003682, DB-015029, HY-101346, LS-172857, RT-016326, B6542, CS-0021189, FT-0675895, J-006297, N-ethyl-1,2-dimethyl-6-methylimino-N-phenylpyrimidin-4-amine hydrochloride, N-Ethyl-1,2-dimethyl-6-(methylimino)-N-phenyl-1,6-dihydropyrimidin-4-amine hydrochloride, 4-Pyrimidinamine, N-ethyl-1,6-dihydro-1,2-dimethyl-6-(methylimino)-N-phenyl-, hydrochloride (1:1), UNII-SN0FR6V4E4, SN0FR6V4E4, C15-H20-N4.Cl-H, DUWKUHWHTPRMAP-UHFFFAOYSA-N, CID123983, ZD-7288, C082246,

Complexity	402
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	292.145g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	292.811g/mol
Monoisotopic Mass	292.145g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	31.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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