ethyl 2-(2-phenylbutanamido)-5-(1-phenylethyl)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-phenylbutanamido)-5-(1-phenylethyl)thiophene-3-carboxylate
ethyl 2-(2-phenylbutanamido)-5-(1-phenylethyl)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-7420 |
| Compound Name: | ethyl 2-(2-phenylbutanamido)-5-(1-phenylethyl)thiophene-3-carboxylate |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C25 H27 N O3 S |
| Smiles: | CCC(C(Nc1c(cc(C(C)c2ccccc2)s1)C(=O)OCC)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.6964 |
| logD: | 5.2046 |
| logSw: | -5.6536 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.606 |
| InChI Key: | XQOCJNALTGVJCF-UHFFFAOYSA-N |