2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
Compound characteristics
| Compound ID: | K297-0534 |
| Compound Name: | 2-{[(2-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)SCc2ccccc2[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2417 |
| logD: | 6.24 |
| logSw: | -6.1986 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.393 |
| InChI Key: | MXGAKYQLYSUERI-UHFFFAOYSA-N |