ethyl 3-acetamido-1-{2-[benzyl(ethyl)amino]-2-oxoethyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-acetamido-1-{2-[benzyl(ethyl)amino]-2-oxoethyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
ethyl 3-acetamido-1-{2-[benzyl(ethyl)amino]-2-oxoethyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C794-1393 |
| Compound Name: | ethyl 3-acetamido-1-{2-[benzyl(ethyl)amino]-2-oxoethyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C26 H31 N3 O4 S |
| Smiles: | CCN(Cc1ccccc1)C(Cn1c(C(=O)OCC)c(c2c3CCCCc3sc12)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3336 |
| logD: | 2.6511 |
| logSw: | -3.7623 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.542 |
| InChI Key: | GTIUCMDRCBDWCU-UHFFFAOYSA-N |