2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(1-phenyl-1H-pyrrol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(1-phenyl-1H-pyrrol-2-yl)acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(1-phenyl-1H-pyrrol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C370-5131 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(1-phenyl-1H-pyrrol-2-yl)acrylamide |
| Molecular Weight: | 381.48 |
| Molecular Formula: | C18 H15 N5 O S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2cccn2c2ccccc2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 4.6 |
| logD: | 4 |
| logSw: | -5.08 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 164.49 |
| InChI Key: | NCMGEOKEBCOHPA-UHFFFAOYSA-N |