3-{5-[(4-chlorobenzyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{5-[(4-chlorobenzyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
3-{5-[(4-chlorobenzyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C639-0320 |
| Compound Name: | 3-{5-[(4-chlorobenzyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 402.88 |
| Molecular Formula: | C17 H11 Cl N4 O2 S2 |
| Smiles: | C(c1ccc(cc1)[Cl])Sc1ccc(/C=C(/C#N)C(Nc2nncs2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.1 |
| logD: | 3.16 |
| logSw: | -4.83 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 185.21 |
| InChI Key: | AURNKTDLTSWZRL-UHFFFAOYSA-N |