N-{5-[1-cyano-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
Chemical Structure Depiction of
N-{5-[1-cyano-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
N-{5-[1-cyano-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
Compound characteristics
| Compound ID: | 3448-6652 |
| Compound Name: | N-{5-[1-cyano-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide |
| Molecular Weight: | 376.44 |
| Molecular Formula: | C20 H16 N4 O2 S |
| Smiles: | Cc1cccc(c1)C(Nc1nnc(C(=C\c2ccc(cc2)OC)\C#N)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5162 |
| logD: | 2.2185 |
| logSw: | -4.4499 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.203 |
| InChI Key: | LTMRMWNEAWOCRR-UHFFFAOYSA-N |