3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinazolin-4(3H)-one
3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-3909 |
| Compound Name: | 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 488.65 |
| Molecular Formula: | C28 H32 N4 O2 S |
| Smiles: | C1CCC(CCN2C(=Nc3ccccc3C2=O)SCC(N2CCN(CC2)c2ccccc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.4188 |
| logD: | 4.4188 |
| logSw: | -4.4047 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.594 |
| InChI Key: | WCSXQDJRSVSIDA-UHFFFAOYSA-N |