2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-{5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-{5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}acrylamide
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-{5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}acrylamide
Compound characteristics
| Compound ID: | C508-0415 |
| Compound Name: | 2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-{5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}acrylamide |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C24 H24 N4 O3 S2 |
| Smiles: | Cc1cccc(c1)OCc1nnc(NC(C(=C/c2ccc(o2)SC2CCCCC2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.75 |
| logD: | 4.51 |
| logSw: | -7.57 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 201.62 |
| InChI Key: | XXPIUIPGKNRWHZ-UHFFFAOYSA-N |