2-[(4-hydroxyquinazolin-2-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(4-hydroxyquinazolin-2-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one
2-[(4-hydroxyquinazolin-2-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | J033-0158 |
| Compound Name: | 2-[(4-hydroxyquinazolin-2-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C21 H22 N4 O3 S |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CSc1nc(c2ccccc2n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8922 |
| logD: | 2.8055 |
| logSw: | -3.2316 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.918 |
| InChI Key: | QTUKEHGCYIIQFF-UHFFFAOYSA-N |