2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-4(3H)-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-3055 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-4(3H)-one |
| Molecular Weight: | 533.09 |
| Molecular Formula: | C29 H29 Cl N4 O2 S |
| Smiles: | C(CC(N1CCN(CC1)c1ccccc1)=O)CN1C(=Nc2ccccc2C1=O)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6565 |
| logD: | 4.6564 |
| logSw: | -4.8792 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.402 |
| InChI Key: | JMRYMXUJYYSNJR-UHFFFAOYSA-N |