5-[(4-methylphenoxy)methyl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(4-methylphenoxy)methyl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
5-[(4-methylphenoxy)methyl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-1083 |
| Compound Name: | 5-[(4-methylphenoxy)methyl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1)OCc1nnc(C(Nc2ccc(cc2)C(N2CCCC2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3277 |
| logD: | 3.321 |
| logSw: | -3.5029 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.571 |
| InChI Key: | KYLDJFXKSUOMJL-UHFFFAOYSA-N |