1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0437 |
| Compound Name: | 1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C27 H30 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(C2CCCC2)C(c2c1ncn2Cc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5181 |
| logD: | 5.5181 |
| logSw: | -5.3915 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.862 |
| InChI Key: | QQWPADFBKAKKJS-UHFFFAOYSA-N |