5-(azepane-1-carbonyl)-1-(3,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-one
Chemical Structure Depiction of
5-(azepane-1-carbonyl)-1-(3,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-one
5-(azepane-1-carbonyl)-1-(3,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | G631-1631 |
| Compound Name: | 5-(azepane-1-carbonyl)-1-(3,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-one |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C19 H26 N2 O4 S |
| Smiles: | Cc1ccc(cc1C)S(N1C(CCC1=O)C(N1CCCCCC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8378 |
| logD: | 2.8378 |
| logSw: | -3.1812 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.194 |
| InChI Key: | GQQNOUYIJIEOPT-KRWDZBQOSA-N |