1-(4-chlorophenyl)-2-{[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-2-{[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl}ethan-1-one
1-(4-chlorophenyl)-2-{[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | K297-0448 |
| Compound Name: | 1-(4-chlorophenyl)-2-{[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 411.95 |
| Molecular Formula: | C22 H22 Cl N3 O S |
| Smiles: | C1CCC(CC1)Nc1c2ccccc2nc(n1)SCC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2234 |
| logD: | 6.2232 |
| logSw: | -6.3504 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.822 |
| InChI Key: | KVFQPHQNCWORGR-UHFFFAOYSA-N |