2-cyano-3-(1H-indol-3-yl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(1H-indol-3-yl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-(1H-indol-3-yl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-2645 |
| Compound Name: | 2-cyano-3-(1H-indol-3-yl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C20 H20 N6 O S |
| Smiles: | CC1CCN(CC1)c1nnc(NC(C(=C/c2c[nH]c3ccccc23)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.23 |
| logD: | 3.89 |
| logSw: | -4.76 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 163.41 |
| InChI Key: | XKPDBQJGZMSRGC-UHFFFAOYSA-N |