3-(4-fluorophenyl)-2-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-fluorophenyl)-2-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
3-(4-fluorophenyl)-2-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V004-7738 |
| Compound Name: | 3-(4-fluorophenyl)-2-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 435.43 |
| Molecular Formula: | C22 H14 F N3 O4 S |
| Smiles: | C(C(c1cccc(c1)[N+]([O-])=O)=O)SC1=Nc2ccccc2C(N1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9115 |
| logD: | 3.9112 |
| logSw: | -4.2292 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.788 |
| InChI Key: | IMZHGVIEYSZGSH-UHFFFAOYSA-N |