7-[(2-chlorophenyl)methyl]-1-cyclopentyl-3-(3-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-1-cyclopentyl-3-(3-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-1-cyclopentyl-3-(3-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-3523 |
| Compound Name: | 7-[(2-chlorophenyl)methyl]-1-cyclopentyl-3-(3-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C23 H20 Cl F N4 O2 |
| Salt: | not_available |
| Smiles: | C1CCC(C1)N1C(c2c(ncn2Cc2ccccc2[Cl])N(C1=O)c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1206 |
| logD: | 4.1206 |
| logSw: | -4.3078 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.862 |
| InChI Key: | ASFUNILCAZIOHU-UHFFFAOYSA-N |