2-cyano-3-(4-methylphenyl)-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-methylphenyl)-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-(4-methylphenyl)-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-0129 |
| Compound Name: | 2-cyano-3-(4-methylphenyl)-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 339.42 |
| Molecular Formula: | C17 H17 N5 O S |
| Smiles: | Cc1ccc(/C=C(/C#N)C(Nc2nnc(N3CCCC3)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.95 |
| logD: | 3.79 |
| logSw: | -4.96 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 141.85 |
| InChI Key: | XMQCHVHAESZDPQ-UHFFFAOYSA-N |