N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(2-methylpropanamido)benzamide
Chemical Structure Depiction of
N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(2-methylpropanamido)benzamide
N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(2-methylpropanamido)benzamide
Compound characteristics
| Compound ID: | D294-2819 |
| Compound Name: | N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3-(2-methylpropanamido)benzamide |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C24 H25 N5 O3 S |
| Smiles: | CC(C)C(Nc1cccc(c1)C(Nc1nnc(C2CC(N(C2)c2ccccc2C)=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0251 |
| logD: | 3.0316 |
| logSw: | -4.0386 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.415 |
| InChI Key: | CHSOCFQYJQSSCJ-KRWDZBQOSA-N |