3-(2-chlorophenyl)-1-cyclopropyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-1-cyclopropyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-1-cyclopropyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1249 |
| Compound Name: | 3-(2-chlorophenyl)-1-cyclopropyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 406.87 |
| Molecular Formula: | C22 H19 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(Cn2cnc3c2C(N(C2CC2)C(N3c2ccccc2[Cl])=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9524 |
| logD: | 3.9524 |
| logSw: | -4.0519 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.526 |
| InChI Key: | MQPGJOHVBVOPIH-UHFFFAOYSA-N |