2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-pentyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-pentyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-pentyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C508-0271 |
| Compound Name: | 2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-pentyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 430.59 |
| Molecular Formula: | C21 H26 N4 O2 S2 |
| Smiles: | CCCCCc1nnc(NC(C(=C/c2ccc(o2)SC2CCCCC2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.95 |
| logD: | 5 |
| logSw: | -6.85 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 195.27 |
| InChI Key: | OWLWHLSCWVZJMG-UHFFFAOYSA-N |