2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}acrylamide
2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}acrylamide
Compound characteristics
Compound ID: | 3537-5311 |
Compound Name: | 2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}acrylamide |
Molecular Weight: | 499.63 |
Molecular Formula: | C28 H29 N5 O2 S |
Smiles: | CCc1nnc(NC(C(=C/c2cn(CCOc3cc(C)ccc3C(C)C)c3ccccc23)\C#N)=O)s1 |
Stereo: | ACHIRAL |
logP: | 6.67 |
logD: | 4.31 |
logSw: | -7.43 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 135 |
InChI Key: | LQXQQVNLJUSFPO-UHFFFAOYSA-N |