2-cyano-3-[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C357-9667 |
| Compound Name: | 2-cyano-3-[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 405.46 |
| Molecular Formula: | C18 H11 N7 O S2 |
| Smiles: | C(=C(/C#N)C(Nc1nncs1)=O)\c1cccn1c1nnc(c2ccccc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.45 |
| logD: | 2.6 |
| logSw: | -4.12 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 182.81 |
| InChI Key: | LRNIVPMXDDIWTD-UHFFFAOYSA-N |