2-cyano-3-(4-hydroxyphenyl)-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-hydroxyphenyl)-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-(4-hydroxyphenyl)-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
Compound ID: | C277-0016 |
Compound Name: | 2-cyano-3-(4-hydroxyphenyl)-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
Molecular Weight: | 346.43 |
Molecular Formula: | C15 H14 N4 O2 S2 |
Smiles: | CC(C)Sc1nc(NC(C(=C/c2ccc(cc2)O)\C#N)=O)sn1 |
Stereo: | ACHIRAL |
logP: | 3.7 |
logD: | 3.02 |
logSw: | -4.68 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 206.06 |
InChI Key: | CVFOTYLAIMUNQY-UHFFFAOYSA-N |