ethyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | E002-1588 |
| Compound Name: | ethyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 435.59 |
| Molecular Formula: | C22 H33 N3 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(N(C(C)C)C1CCN(CC1)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9343 |
| logD: | 3.6689 |
| logSw: | -4.0153 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.031 |
| InChI Key: | QBINEESOWDANHI-UHFFFAOYSA-N |