4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid structure

4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid

4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid

Also Known As: 4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid|4-(2,4-Diamino-8-oxo-6,8-dihydro-7H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid|4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic

CAS: 79722-42-2
Molecular Formula C15H11N7O3
Molecular Weight 337.09235 g/mol
LogP -0.4
Topological Polar Surface Area 161.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 9
Rotatable Bonds 2
Exact Mass 337.09235
Monoisotopic Mass 337.09235
Heavy Atoms 25
Complexity 553.0

Chemical Identifiers

CAS Number 79722-42-2
SMILES C1C2=C(C(=O)N1C3=CC=C(C=C3)C(=O)O)N=C4C(=N2)C(=NC(=N4)N)N
InChIKey SYNNRVYMWIAFNX-UHFFFAOYSA-N

Product Overview

4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid (CAS 79722-42-2), with molecular formula C15H11N7O3 and molecular weight 337.09235 g/mol. IUPAC: 4-(2,4-diamino-8-oxo-6H-pyrrolo[3,4-g]pteridin-7-yl)benzoic acid.

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