Oprea1_839251

4-(1,3-dimethyl-2,4-dioxo-5-phenylpyrrolo[3,4-d]pyrimidin-6-yl)benzoic acid

Also Known As: Oprea1_839251|4-(1,3-dimethyl-2,4-dioxo-5-phenyl-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl)benzoic acid|A2863/0120718|SR-01000502134-1|Benzoic acid, 4-(1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-5-phenyl-6H-pyrrolo[3,4-d]pyrimidin-6-yl)-|4-(1,3-dimethyl-2,4-dioxo-5-phenylpyrrolo[3,4-d]pyrimidin-6-yl)benzoic acid|4-(1,2,3,4-Tetrahydro-1,3-dimethyl-2,4-dioxo-5-phenyl-6H-pyrrolo[3,4-d]pyrimidin-6-yl)benzoic acid

Molecular Formula	C21H17N3O4
Molecular Weight	375.12192 g/mol
LogP	2.3931
Topological Polar Surface Area	86.23 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	375.12192
Monoisotopic Mass	375.12192
Heavy Atoms	28
Complexity	1326.8263

Chemical Identifiers

CAS Number	433971-13-2
SMILES	CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)O