3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0548 |
| Compound Name: | 3-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C23 H23 F N2 O S |
| Smiles: | C1CCC(CCN2C(=Nc3ccccc3C2=O)SCc2cccc(c2)F)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.2449 |
| logD: | 5.2449 |
| logSw: | -5.3249 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.9415 |
| InChI Key: | NJAWMJJTMAARSG-UHFFFAOYSA-N |