ethyl 2-(2-phenylbutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-phenylbutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-phenylbutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V015-4952 |
| Compound Name: | ethyl 2-(2-phenylbutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C21 H25 N O3 S |
| Smiles: | CCC(C(Nc1c(C(=O)OCC)c2CCCCc2s1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.114 |
| logD: | 1.9168 |
| logSw: | -5.0248 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.798 |
| InChI Key: | ZZIAGENOXJGIDV-OAHLLOKOSA-N |