3-(3-chlorophenyl)-7-(cyclopropylmethyl)-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-7-(cyclopropylmethyl)-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(3-chlorophenyl)-7-(cyclopropylmethyl)-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V022-4619 |
| Compound Name: | 3-(3-chlorophenyl)-7-(cyclopropylmethyl)-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 424.86 |
| Molecular Formula: | C22 H18 Cl F N4 O2 |
| Smiles: | C1CC1Cn1cnc2c1C(N(Cc1ccc(cc1)F)C(N2c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0352 |
| logD: | 4.0352 |
| logSw: | -4.3231 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.798 |
| InChI Key: | KXZJJIKYHKWYCO-UHFFFAOYSA-N |