N-benzyl-1-(3-chloro-4-methylphenyl)-4-(ethanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(3-chloro-4-methylphenyl)-4-(ethanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
N-benzyl-1-(3-chloro-4-methylphenyl)-4-(ethanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-2967 |
| Compound Name: | N-benzyl-1-(3-chloro-4-methylphenyl)-4-(ethanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 463.98 |
| Molecular Formula: | C22 H26 Cl N3 O4 S |
| Smiles: | CCS(N1CC(N(c2ccc(C)c(c2)[Cl])C(C)(C1)C(NCc1ccccc1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0537 |
| logD: | 3.0537 |
| logSw: | -3.5202 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.836 |
| InChI Key: | JROALADSXUPBMY-QFIPXVFZSA-N |