AC1O2K3J

7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-[(2E)-2-(3-methylcyclohexylidene)hydrazinyl]purine-2,6-dione

Also Known As: (E)-7-(4-chlorobenzyl)-1,3-dimethyl-8-(2-(3-methylcyclohexylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione|(8E)-7-(4-chlorobenzyl)-1,3-dimethyl-8-[(2E)-(3-methylcyclohexylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione|7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-[(2E)-2-(3-methylcyclohexylidene)hydrazinyl]purine-2,6-dione|7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-[2-(3-methylcyclohexylidene)hydrazinyl]purine-2,6-dione

Molecular Formula	C21H25ClN6O2
Molecular Weight	428.17276 g/mol
LogP	3.1134
Topological Polar Surface Area	86.21 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	428.17276
Monoisotopic Mass	428.17276
Heavy Atoms	30
Complexity	1235.5907

Chemical Identifiers

CAS Number	713095-41-1
SMILES	CC1CCC/C(=N\NC2=NC3=C(N2CC4=CC=C(C=C4)Cl)C(=O)N(C(=O)N3C)C)/C1