N-cyclooctyl-4-(ethanesulfonyl)-2-methyl-1-(4-methylphenyl)-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-4-(ethanesulfonyl)-2-methyl-1-(4-methylphenyl)-6-oxopiperazine-2-carboxamide
N-cyclooctyl-4-(ethanesulfonyl)-2-methyl-1-(4-methylphenyl)-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-0781 |
| Compound Name: | N-cyclooctyl-4-(ethanesulfonyl)-2-methyl-1-(4-methylphenyl)-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C23 H35 N3 O4 S |
| Smiles: | CCS(N1CC(N(c2ccc(C)cc2)C(C)(C1)C(NC1CCCCCCC1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5732 |
| logD: | 3.5732 |
| logSw: | -3.7619 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.892 |
| InChI Key: | AIMKHWMEQWTMEN-QHCPKHFHSA-N |