2-{[(4-chlorophenyl)methyl]sulfanyl}-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-4500 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one |
| Molecular Weight: | 587.18 |
| Molecular Formula: | C33 H35 Cl N4 O2 S |
| Smiles: | C1CC(CCC1CN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)[Cl])C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3883 |
| logD: | 6.3882 |
| logSw: | -6.3049 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.872 |
| InChI Key: | RYBQZNVSBCMZPT-UHFFFAOYSA-N |