N~1~-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
Chemical Structure Depiction of
N~1~-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
N~1~-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
Compound characteristics
| Compound ID: | C508-0490 |
| Compound Name: | N~1~-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-cyano-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C25 H24 N4 O3 S2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1nnc(NC(C(=C/c2ccc(o2)SCc2ccco2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 7.05 |
| logD: | 5.14 |
| logSw: | -7.71 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 186.22 |
| InChI Key: | ZNNBSZJZXAUFMM-UHFFFAOYSA-N |