2-cyano-3-(4-isopropylphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-isopropylphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-(4-isopropylphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-2577 |
| Compound Name: | 2-cyano-3-(4-isopropylphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 395.53 |
| Molecular Formula: | C21 H25 N5 O S |
| Smiles: | CC1CCN(CC1)c1nnc(NC(C(=C/c2ccc(cc2)C(C)C)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.5 |
| logD: | 5.34 |
| logSw: | -6.35 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 147.47 |
| InChI Key: | KNJPGYKYBSVRCP-UHFFFAOYSA-N |