3-[1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C370-3607 |
| Compound Name: | 3-[1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 429.88 |
| Molecular Formula: | C19 H16 Cl N5 O3 S |
| Smiles: | Cc1nnc(NC(C(=C/c2cccn2c2cc(c(cc2OC)OC)[Cl])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.93 |
| logD: | 2.07 |
| logSw: | -5.16 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 158.68 |
| InChI Key: | JTWRRBLQQFZOGJ-UHFFFAOYSA-N |