3-(2-chlorophenyl)-1-cyclohexyl-7-[(3-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-1-cyclohexyl-7-[(3-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-1-cyclohexyl-7-[(3-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1482 |
| Compound Name: | 3-(2-chlorophenyl)-1-cyclohexyl-7-[(3-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C25 H25 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(Cn2cnc3c2C(N(C2CCCCC2)C(N3c2ccccc2[Cl])=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5264 |
| logD: | 4.5264 |
| logSw: | -4.5766 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.739 |
| InChI Key: | LKJNUVKTNZAJAF-UHFFFAOYSA-N |