ethyl 6-ethyl-2-(3,5,5-trimethylhexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-ethyl-2-(3,5,5-trimethylhexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-ethyl-2-(3,5,5-trimethylhexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-6926 |
| Compound Name: | ethyl 6-ethyl-2-(3,5,5-trimethylhexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 393.59 |
| Molecular Formula: | C22 H35 N O3 S |
| Smiles: | CCC1CCc2c(C(=O)OCC)c(NC(CC(C)CC(C)(C)C)=O)sc2C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3614 |
| logD: | 3.8428 |
| logSw: | -5.6033 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.856 |
| InChI Key: | FDZHRPBDZDXHHC-UHFFFAOYSA-N |