2-{[(4-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
2-{[(4-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
Compound characteristics
| Compound ID: | K297-0535 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine |
| Molecular Weight: | 421.95 |
| Molecular Formula: | C23 H20 Cl N3 O S |
| Smiles: | COc1ccc(CNc2c3ccccc3nc(n2)SCc2ccc(cc2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9002 |
| logD: | 5.8984 |
| logSw: | -6.196 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.393 |
| InChI Key: | XQRVMWUEJAHFGG-UHFFFAOYSA-N |