AG002GFD

192869-80-0 | Pyrido[3,4-d]pyrimidine, 4-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)-

AG002GFD

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CAS Number	192869-80-0
Catalog Number	AG002GFD(AGN-PC-03IBE7)
Chemical Name	Pyrido[3,4-d]pyrimidine, 4-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)-
IUPAC Name	7-benzyl-4-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
InChI	InChI=1S/C14H14ClN3/c15-14-12-6-7-18(9-13(12)16-10-17-14)8-11-4-2-1-3-5-11/h1-5,10H,6-9H2
InChI Key	ZUDXEFPMOWJJQK-UHFFFAOYSA-N
MDL Number	MFCD09030049
Molecular Formula	C14H14ClN3
Molecular Weight	259.7341
SMILES	ClC1=C2C(CN(CC3=CC=CC=C3)CC2)=NC=N1
Synonyms	192869-80-0, 7-Benzyl-4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine, AK-27556, 7-Benzyl-4-chloro-5,6,7,8-tetrahydro-pyrido[3,4-d]pyrimidine, Pyrido[3,4-d]pyrimidine, 4-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)-, 7-benzyl-4-chloro-5H,6H,7H,8H-pyrido[3,4-d]pyrimidine, 7-benzyl-4-chloro-5,6,7,8-tetrahydroquinazoline, 7-Benzyl-4-chloro-5,6,7,8-tetrahydro-quinazoline, SCHEMBL1549990, CTK4E1111, DTXSID40620802, ZUDXEFPMOWJJQK-UHFFFAOYSA-N, KS-00000PL1, ANW-48553, CB0238, MFCD09030049, ZINC21987933, AKOS015839174, FCH2793355, AJ-79573, AM807728, AN-30260, BR-27556, CJ-17131, DS-10838, AB0023129, AX8224113, DB-013983, TR-008955, 4CH-011281, A4249, FT-0645491, ST24024475, W4127, S-6588, I14-15424, 7-benzyl-4-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine, 7-benzyl4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine, 7-benzyl-4-chloro-5,6,7,8-tetrahydro-1,3,7-triazanaphthalene, 7-benzyl-4-chloro-5,6,7,8-tetrahydro-pyrido[3.4-d]pyrimidine, Pyrido[3,4-d]pyrimidine,4-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)-, C14H14ClN3, 7-BENZYL-5,6,7,8-TETRAHYDRO4-CHLORO-PYRIDO[3,4-D]PYRIMIDINE HYDROCHLORIDE,

Complexity	268
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	259.088g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	259.737g/mol
Monoisotopic Mass	259.088g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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