5-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0537 |
| Compound Name: | 5-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(CCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0636 |
| logD: | 4.0636 |
| logSw: | -4.0751 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.207 |
| InChI Key: | MSQSYBPYLGJZFW-UHFFFAOYSA-N |