2-cyano-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]-3-(5-nitro-2-furyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]-3-(5-nitro-2-furyl)acrylamide
2-cyano-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]-3-(5-nitro-2-furyl)acrylamide
Compound characteristics
| Compound ID: | C726-2816 |
| Compound Name: | 2-cyano-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]-3-(5-nitro-2-furyl)acrylamide |
| Molecular Weight: | 388.4 |
| Molecular Formula: | C16 H16 N6 O4 S |
| Smiles: | CC1CCN(CC1)c1nnc(NC(C(=C/c2ccc([N+]([O-])=O)o2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.22 |
| logD: | 3.06 |
| logSw: | -4.21 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 237.33 |
| InChI Key: | NMEZUVMIZHIQSL-UHFFFAOYSA-N |