2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-3073 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4(3H)-one |
| Molecular Weight: | 519.06 |
| Molecular Formula: | C28 H27 Cl N4 O2 S |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)[Cl])C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3087 |
| logD: | 4.3087 |
| logSw: | -4.7851 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.402 |
| InChI Key: | XPJMDWVPOAYFJE-UHFFFAOYSA-N |