2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-3251 |
| Compound Name: | 2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 455.56 |
| Molecular Formula: | C21 H21 N5 O3 S2 |
| Smiles: | CC1CCN(CC1)c1nnc(NC(C(=C/c2ccc(o2)SCc2ccco2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.26 |
| logD: | 5.1 |
| logSw: | -6.25 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 200.33 |
| InChI Key: | LRXSKBQZNMEIKD-UHFFFAOYSA-N |