3-[1-(3-chloro-4-methoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(3-chloro-4-methoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[1-(3-chloro-4-methoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C370-3654 |
| Compound Name: | 3-[1-(3-chloro-4-methoxyphenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 413.88 |
| Molecular Formula: | C19 H16 Cl N5 O2 S |
| Smiles: | CCc1nnc(NC(C(=C/c2cccn2c2ccc(c(c2)[Cl])OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.39 |
| logD: | 2.55 |
| logSw: | -5.12 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 144.28 |
| InChI Key: | YOYOYGRIXLTZKL-UHFFFAOYSA-N |