ethyl 2-[3-(azepane-1-sulfonyl)benzamido]-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[3-(azepane-1-sulfonyl)benzamido]-4,5-dimethylthiophene-3-carboxylate
ethyl 2-[3-(azepane-1-sulfonyl)benzamido]-4,5-dimethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | G856-2398 |
| Compound Name: | ethyl 2-[3-(azepane-1-sulfonyl)benzamido]-4,5-dimethylthiophene-3-carboxylate |
| Molecular Weight: | 464.6 |
| Molecular Formula: | C22 H28 N2 O5 S2 |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1cccc(c1)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3559 |
| logD: | 0.0215 |
| logSw: | -4.2526 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.92 |
| InChI Key: | QKTAYIAHHVWFMR-UHFFFAOYSA-N |