2-cyano-3-(4-methoxyphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-methoxyphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-(4-methoxyphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-2592 |
| Compound Name: | 2-cyano-3-(4-methoxyphenyl)-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C19 H21 N5 O2 S |
| Smiles: | CC1CCN(CC1)c1nnc(NC(C(=C/c2ccc(cc2)OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.14 |
| logD: | 3.99 |
| logSw: | -5.13 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 158.24 |
| InChI Key: | VNOROKTUIRYRSQ-UHFFFAOYSA-N |