4-cyano-5-[2-(2,4-dichlorophenoxy)acetamido]-N,N,3-trimethylthiophene-2-carboxamide
Chemical Structure Depiction of
4-cyano-5-[2-(2,4-dichlorophenoxy)acetamido]-N,N,3-trimethylthiophene-2-carboxamide
4-cyano-5-[2-(2,4-dichlorophenoxy)acetamido]-N,N,3-trimethylthiophene-2-carboxamide
Compound characteristics
Compound ID: | Y205-0623 |
Compound Name: | 4-cyano-5-[2-(2,4-dichlorophenoxy)acetamido]-N,N,3-trimethylthiophene-2-carboxamide |
Molecular Weight: | 412.29 |
Molecular Formula: | C17 H15 Cl2 N3 O3 S |
Smiles: | Cc1c(C#N)c(NC(COc2ccc(cc2[Cl])[Cl])=O)sc1C(N(C)C)=O |
Stereo: | ACHIRAL |
logP: | 2.7825 |
logD: | 2.1194 |
logSw: | -3.6973 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.553 |
InChI Key: | BMCXPNRDTQIFLG-UHFFFAOYSA-N |