2-{[(2,6-dichlorophenyl)methyl]sulfanyl}-3-methylquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2,6-dichlorophenyl)methyl]sulfanyl}-3-methylquinazolin-4(3H)-one
2-{[(2,6-dichlorophenyl)methyl]sulfanyl}-3-methylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y502-5022 |
| Compound Name: | 2-{[(2,6-dichlorophenyl)methyl]sulfanyl}-3-methylquinazolin-4(3H)-one |
| Molecular Weight: | 351.25 |
| Molecular Formula: | C16 H12 Cl2 N2 O S |
| Smiles: | CN1C(=Nc2ccccc2C1=O)SCc1c(cccc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1205 |
| logD: | 4.1205 |
| logSw: | -4.3849 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.8082 |
| InChI Key: | DHAUVSWPKPRQKN-UHFFFAOYSA-N |