2-[(4-{[(4-chlorophenyl)methyl]amino}quinazolin-2-yl)sulfanyl]-1-(3,4-dichlorophenyl)ethan-1-one
Chemical Structure Depiction of
2-[(4-{[(4-chlorophenyl)methyl]amino}quinazolin-2-yl)sulfanyl]-1-(3,4-dichlorophenyl)ethan-1-one
2-[(4-{[(4-chlorophenyl)methyl]amino}quinazolin-2-yl)sulfanyl]-1-(3,4-dichlorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | K297-0161 |
| Compound Name: | 2-[(4-{[(4-chlorophenyl)methyl]amino}quinazolin-2-yl)sulfanyl]-1-(3,4-dichlorophenyl)ethan-1-one |
| Molecular Weight: | 488.82 |
| Molecular Formula: | C23 H16 Cl3 N3 O S |
| Smiles: | C(c1ccc(cc1)[Cl])Nc1c2ccccc2nc(n1)SCC(c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.2396 |
| logD: | 7.2393 |
| logSw: | -6.7036 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.096 |
| InChI Key: | XJCKONAAUQRHPA-UHFFFAOYSA-N |