7-[(4-tert-butylphenyl)methyl]-3-(2-chlorophenyl)-1-cyclopentyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-tert-butylphenyl)methyl]-3-(2-chlorophenyl)-1-cyclopentyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-tert-butylphenyl)methyl]-3-(2-chlorophenyl)-1-cyclopentyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V022-9118 |
| Compound Name: | 7-[(4-tert-butylphenyl)methyl]-3-(2-chlorophenyl)-1-cyclopentyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 477.01 |
| Molecular Formula: | C27 H29 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(Cn2cnc3c2C(N(C2CCCC2)C(N3c2ccccc2[Cl])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6796 |
| logD: | 5.6796 |
| logSw: | -5.8325 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.561 |
| InChI Key: | LSNYCQSBVFNDEZ-UHFFFAOYSA-N |