methyl 3-acetamido-1-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 3-acetamido-1-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
methyl 3-acetamido-1-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E649-1725 |
| Compound Name: | methyl 3-acetamido-1-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C22 H24 N2 O3 S |
| Smiles: | CC(Nc1c2c3CCCCc3sc2n(Cc2cccc(C)c2)c1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1226 |
| logD: | 3.5534 |
| logSw: | -4.5503 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.283 |
| InChI Key: | VOJMIPYDYKGNSO-UHFFFAOYSA-N |