ethyl 2-(5-ethoxy-5-oxopentanamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(5-ethoxy-5-oxopentanamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(5-ethoxy-5-oxopentanamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-6939 |
| Compound Name: | ethyl 2-(5-ethoxy-5-oxopentanamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 409.54 |
| Molecular Formula: | C21 H31 N O5 S |
| Smiles: | CCCC1CCc2c(C(=O)OCC)c(NC(CCCC(=O)OCC)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4202 |
| logD: | 2.0964 |
| logSw: | -4.3171 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.015 |
| InChI Key: | XCERXMZYWJEJJF-CQSZACIVSA-N |