2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
Compound characteristics
| Compound ID: | C508-0508 |
| Compound Name: | 2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C21 H20 N4 O3 S2 |
| Smiles: | C1CCC(CC1)c1nnc(NC(C(=C/c2ccc(o2)SCc2ccco2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.72 |
| logD: | 3.79 |
| logSw: | -6.6 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 195.38 |
| InChI Key: | XAUGHNHJPRMJDV-UHFFFAOYSA-N |