N-benzyl-4-(ethanesulfonyl)-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-4-(ethanesulfonyl)-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxopiperazine-2-carboxamide
N-benzyl-4-(ethanesulfonyl)-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-3026 |
| Compound Name: | N-benzyl-4-(ethanesulfonyl)-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C24 H31 N3 O4 S |
| Smiles: | CCc1ccc(CN2C(CN(CC2(C)C(NCc2ccccc2)=O)S(CC)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1231 |
| logD: | 3.123 |
| logSw: | -3.335 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.447 |
| InChI Key: | ZLSXVBVQJRWRJF-DEOSSOPVSA-N |