2-cyano-3-[5-(1-naphthylsulfanyl)-2-furyl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(1-naphthylsulfanyl)-2-furyl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[5-(1-naphthylsulfanyl)-2-furyl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C508-0317 |
| Compound Name: | 2-cyano-3-[5-(1-naphthylsulfanyl)-2-furyl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 510.59 |
| Molecular Formula: | C27 H18 N4 O3 S2 |
| Smiles: | C(c1nnc(NC(C(=C/c2ccc(o2)Sc2cccc3ccccc23)\C#N)=O)s1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.68 |
| logD: | 4.45 |
| logSw: | -7.46 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 185.52 |
| InChI Key: | BFVXUIAGAROVBB-UHFFFAOYSA-N |