N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
Chemical Structure Depiction of
N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
Compound characteristics
| Compound ID: | D294-0461 |
| Compound Name: | N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C21 H19 Cl N4 O2 S |
| Smiles: | Cc1cccc(c1)C(Nc1nnc(C2CC(N(C2)c2ccc(C)c(c2)[Cl])=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7716 |
| logD: | 3.3186 |
| logSw: | -4.8327 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.353 |
| InChI Key: | RHCULFYGHYKJJI-OAHLLOKOSA-N |