ethyl 3-acetamido-1-{[3-(trifluoromethyl)phenyl]methyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-acetamido-1-{[3-(trifluoromethyl)phenyl]methyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
ethyl 3-acetamido-1-{[3-(trifluoromethyl)phenyl]methyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C794-1346 |
| Compound Name: | ethyl 3-acetamido-1-{[3-(trifluoromethyl)phenyl]methyl}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C23 H23 F3 N2 O3 S |
| Smiles: | CCOC(c1c(c2c3CCCCc3sc2n1Cc1cccc(c1)C(F)(F)F)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5827 |
| logD: | 4.0135 |
| logSw: | -4.6881 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.862 |
| InChI Key: | YRQOJGCZKWSSCV-UHFFFAOYSA-N |