N-(3-chloro-2-methylphenyl)-2-{1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-{1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}acetamide
N-(3-chloro-2-methylphenyl)-2-{1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}acetamide
Compound characteristics
| Compound ID: | Y020-7394 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-{1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}acetamide |
| Molecular Weight: | 446.95 |
| Molecular Formula: | C21 H23 Cl N4 O3 S |
| Smiles: | Cc1c(cccc1[Cl])NC(CC1C(NCCN1C(Nc1ccc(cc1)OC)=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2248 |
| logD: | 3.2239 |
| logSw: | -3.531 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.411 |
| InChI Key: | CQXPAYRVBJZRLG-SFHVURJKSA-N |