N-cyclooctyl-1-(3,5-dimethylphenyl)-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-1-(3,5-dimethylphenyl)-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
N-cyclooctyl-1-(3,5-dimethylphenyl)-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-0616 |
| Compound Name: | N-cyclooctyl-1-(3,5-dimethylphenyl)-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C23 H35 N3 O4 S |
| Smiles: | Cc1cc(C)cc(c1)N1C(CN(CC1(C)C(NC1CCCCCCC1)=O)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8651 |
| logD: | 3.8651 |
| logSw: | -3.7897 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.49 |
| InChI Key: | KBBOIIDEGJASMZ-QHCPKHFHSA-N |