2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(5-phenyl-2-furyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(5-phenyl-2-furyl)acrylamide
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(5-phenyl-2-furyl)acrylamide
Compound characteristics
Compound ID: | C356-0540 |
Compound Name: | 2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(5-phenyl-2-furyl)acrylamide |
Molecular Weight: | 414.46 |
Molecular Formula: | C18 H14 N4 O4 S2 |
Smiles: | CCS(c1nnc(NC(C(=C/c2ccc(c3ccccc3)o2)\C#N)=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.71 |
logD: | 1.34 |
logSw: | -4.64 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 205.44 |
InChI Key: | VWNGZRAQGDWZJB-UHFFFAOYSA-N |