N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-2854 |
| Compound Name: | N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-(3-methylbutyl)-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 471.62 |
| Molecular Formula: | C25 H33 N3 O4 S |
| Smiles: | CC(C)CCN1C(CN(CC1(C)C(NCc1ccccc1)=O)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9396 |
| logD: | 3.9395 |
| logSw: | -3.8316 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.531 |
| InChI Key: | HLHHJYLMARXAOF-VWLOTQADSA-N |