N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-ethoxybenzamide
Chemical Structure Depiction of
N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-ethoxybenzamide
N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-ethoxybenzamide
Compound characteristics
| Compound ID: | D294-1759 |
| Compound Name: | N-{5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-ethoxybenzamide |
| Molecular Weight: | 456.95 |
| Molecular Formula: | C22 H21 Cl N4 O3 S |
| Smiles: | CCOc1ccccc1C(Nc1nnc(C2CC(N(C2)c2ccc(C)c(c2)[Cl])=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6795 |
| logD: | 2.4946 |
| logSw: | -4.8654 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.563 |
| InChI Key: | CSCPBDXGOUPFCS-CQSZACIVSA-N |