N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(phenylsulfanyl)propanamide
Chemical Structure Depiction of
N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(phenylsulfanyl)propanamide
N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(phenylsulfanyl)propanamide
Compound characteristics
| Compound ID: | D294-3335 |
| Compound Name: | N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(phenylsulfanyl)propanamide |
| Molecular Weight: | 452.6 |
| Molecular Formula: | C23 H24 N4 O2 S2 |
| Smiles: | Cc1cc(C)cc(c1)N1CC(CC1=O)c1nnc(NC(CCSc2ccccc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6133 |
| logD: | 4.347 |
| logSw: | -4.2816 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.139 |
| InChI Key: | XAEHRLPZYSXFHH-KRWDZBQOSA-N |