ethyl 6-methyl-2-(2-methylpentanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-2-(2-methylpentanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-methyl-2-(2-methylpentanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V007-2386 |
| Compound Name: | ethyl 6-methyl-2-(2-methylpentanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 337.48 |
| Molecular Formula: | C18 H27 N O3 S |
| Smiles: | CCCC(C)C(Nc1c(C(=O)OCC)c2CCC(C)Cc2s1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8491 |
| logD: | 2.2741 |
| logSw: | -4.65 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.07 |
| InChI Key: | VKQJBICZGZAFPM-UHFFFAOYSA-N |