C21H21N7O2

1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]purine-2,6-dione

Also Known As: (E)-1,3-dimethyl-7-(4-methylbenzyl)-8-(2-(pyridin-3-ylmethylene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione|1,3-dimethyl-7-(4-methylbenzyl)-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione|1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-(2-(pyridin-3-ylmethylidene)hydrazinyl)purine-2,6-dione

Molecular Formula	C21H21N7O2
Molecular Weight	403.17566 g/mol
LogP	1.63142
Topological Polar Surface Area	99.1 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	403.17566
Monoisotopic Mass	403.17566
Heavy Atoms	30
Complexity	1346.8717

Chemical Identifiers

CAS Number	536718-60-2
SMILES	CC1=CC=C(C=C1)CN2C3=C(N=C2N/N=C/C4=CN=CC=C4)N(C(=O)N(C3=O)C)C