3-(2,5-dichlorophenyl)-2-{[(3,4-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2,5-dichlorophenyl)-2-{[(3,4-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-(2,5-dichlorophenyl)-2-{[(3,4-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V003-2866 |
| Compound Name: | 3-(2,5-dichlorophenyl)-2-{[(3,4-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 441.38 |
| Molecular Formula: | C23 H18 Cl2 N2 O S |
| Smiles: | Cc1ccc(CSC2=Nc3ccccc3C(N2c2cc(ccc2[Cl])[Cl])=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 6.2794 |
| logD: | 6.2794 |
| logSw: | -6.0009 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.8586 |
| InChI Key: | LQBBHATTWYELQJ-UHFFFAOYSA-N |