N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[4-(1-phenylethoxy)phenyl]acrylamide
Chemical Structure Depiction of
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[4-(1-phenylethoxy)phenyl]acrylamide
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[4-(1-phenylethoxy)phenyl]acrylamide
Compound characteristics
| Compound ID: | 4272-0018 |
| Compound Name: | N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[4-(1-phenylethoxy)phenyl]acrylamide |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C24 H24 N4 O2 S |
| Smiles: | CCCCc1nnc(NC(C(=C/c2ccc(cc2)OC(C)c2ccccc2)\C#N)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.24 |
| logD: | 4.31 |
| logSw: | -6.59 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 146.22 |
| InChI Key: | JAQOHEKIYGAUHT-KRWDZBQOSA-N |