2-cyano-3-[2,5-dimethyl-1-(1-naphthyl)-1H-pyrrol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[2,5-dimethyl-1-(1-naphthyl)-1H-pyrrol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[2,5-dimethyl-1-(1-naphthyl)-1H-pyrrol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0093 |
| Compound Name: | 2-cyano-3-[2,5-dimethyl-1-(1-naphthyl)-1H-pyrrol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C23 H19 N5 O S |
| Smiles: | Cc1cc(/C=C(/C#N)C(Nc2nnc(C)s2)=O)c(C)n1c1cccc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.37 |
| logD: | 3.1 |
| logSw: | -5.28 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 140.59 |
| InChI Key: | VXMUDMBTBXIYGE-UHFFFAOYSA-N |