2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)acrylamide
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)acrylamide
Compound characteristics
| Compound ID: | 4011-0118 |
| Compound Name: | 2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)acrylamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C24 H25 N5 O S |
| Smiles: | Cc1cc(/C=C(/C#N)C(Nc2nnc(C3CCCCC3)s2)=O)c(C)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.24 |
| logD: | 4.01 |
| logSw: | -6.06 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 131.84 |
| InChI Key: | CUVCKQVOURQLFQ-UHFFFAOYSA-N |