methyl 2-[2-(azepan-1-yl)acetamido]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(azepan-1-yl)acetamido]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
methyl 2-[2-(azepan-1-yl)acetamido]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6228 |
| Compound Name: | methyl 2-[2-(azepan-1-yl)acetamido]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 381.49 |
| Molecular Formula: | C18 H27 N3 O4 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(CN2CCCCCC2)=O)sc1C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9964 |
| logD: | 0.3143 |
| logSw: | -2.4697 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.42 |
| InChI Key: | DEBOQQMWKVBZQA-UHFFFAOYSA-N |