AC1Q3SGS

3-[2-amino-4-(4-chlorophenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoic acid

Also Known As: 3-[2-amino-4-(4-chlorophenyl)-7-oxo-5,7-dihydro-6h-pyrrolo[3,4-d]pyrimidin-6-yl]propanoic acid|3-(2-Amino-4-(4-chlorophenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-6(7H)-yl)propanoic acid|3-[2-amino-4-(4-chlorophenyl)-7-oxo-5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoic acid|3-[2-amino-4-(4-chlorophenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimid|3-[2-amino-4-(4-chlorophenyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoic acid|3-[3-amino-5-(4-chlorophenyl)-9-oxo-2,4,8-triazabicyclo[4.3.0]nona-1,3,5-trien-8-yl]propanoic acid

Molecular Formula	C15H13ClN4O3
Molecular Weight	332.06763 g/mol
LogP	1.0
Topological Polar Surface Area	109.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	332.06763
Monoisotopic Mass	332.06763
Heavy Atoms	23
Complexity	470.0

Chemical Identifiers

CAS Number	774-22-1
SMILES	C1C2=C(N=C(N=C2C(=O)N1CCC(=O)O)N)C3=CC=C(C=C3)Cl
InChIKey	DKAKXTMOKIYELP-UHFFFAOYSA-N