2-(benzylsulfanyl)-3-(3,4-dichlorophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-3-(3,4-dichlorophenyl)quinazolin-4(3H)-one
2-(benzylsulfanyl)-3-(3,4-dichlorophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V005-9615 |
| Compound Name: | 2-(benzylsulfanyl)-3-(3,4-dichlorophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 413.32 |
| Molecular Formula: | C21 H14 Cl2 N2 O S |
| Smiles: | C(c1ccccc1)SC1=Nc2ccccc2C(N1c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2377 |
| logD: | 5.2377 |
| logSw: | -5.6643 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.1595 |
| InChI Key: | WWHQKPSKEZQNAE-UHFFFAOYSA-N |