2-{[(3-chlorophenyl)methyl]sulfanyl}-N-(4-fluorophenyl)quinazolin-4-amine
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-N-(4-fluorophenyl)quinazolin-4-amine
2-{[(3-chlorophenyl)methyl]sulfanyl}-N-(4-fluorophenyl)quinazolin-4-amine
Compound characteristics
| Compound ID: | K297-0578 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-N-(4-fluorophenyl)quinazolin-4-amine |
| Molecular Weight: | 395.88 |
| Molecular Formula: | C21 H15 Cl F N3 S |
| Smiles: | C(c1cccc(c1)[Cl])Sc1nc(c2ccccc2n1)Nc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 6.7154 |
| logD: | 6.7151 |
| logSw: | -6.8253 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.5272 |
| InChI Key: | YMFGURULCPGIBC-UHFFFAOYSA-N |