ethyl 5-(4-tert-butylbenzamido)-4-cyano-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-tert-butylbenzamido)-4-cyano-3-methylthiophene-2-carboxylate
ethyl 5-(4-tert-butylbenzamido)-4-cyano-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y203-6694 |
| Compound Name: | ethyl 5-(4-tert-butylbenzamido)-4-cyano-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C20 H22 N2 O3 S |
| Smiles: | CCOC(c1c(C)c(C#N)c(NC(c2ccc(cc2)C(C)(C)C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9396 |
| logD: | 2.412 |
| logSw: | -4.6629 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.934 |
| InChI Key: | HMANSFDSVALORS-UHFFFAOYSA-N |