N-[3-(azepane-1-carbonyl)phenyl]-5-ethyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[3-(azepane-1-carbonyl)phenyl]-5-ethyl-1,3,4-thiadiazole-2-carboxamide
N-[3-(azepane-1-carbonyl)phenyl]-5-ethyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F854-0041 |
| Compound Name: | N-[3-(azepane-1-carbonyl)phenyl]-5-ethyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C18 H22 N4 O2 S |
| Smiles: | CCc1nnc(C(Nc2cccc(c2)C(N2CCCCCC2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0686 |
| logD: | 3.0686 |
| logSw: | -3.3893 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.308 |
| InChI Key: | YJNHDAMCVWFKSP-UHFFFAOYSA-N |