N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
Chemical Structure Depiction of
N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
Compound characteristics
| Compound ID: | D294-2279 |
| Compound Name: | N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C21 H26 N4 O2 S |
| Smiles: | Cc1cc(C)cc(c1)N1CC(CC1=O)c1nnc(NC(C2CCCCC2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3388 |
| logD: | 4.0203 |
| logSw: | -4.2026 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.545 |
| InChI Key: | NRNZHCRRIKEFSW-INIZCTEOSA-N |