N-[(4-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine
N-[(4-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine
Compound characteristics
| Compound ID: | K297-0117 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-{[(2-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine |
| Molecular Weight: | 426.37 |
| Molecular Formula: | C22 H17 Cl2 N3 S |
| Smiles: | C(c1ccc(cc1)[Cl])Nc1c2ccccc2nc(n1)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.8541 |
| logD: | 6.8523 |
| logSw: | -6.7092 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8494 |
| InChI Key: | AGQFAJWFOZBSEL-UHFFFAOYSA-N |