ethyl 3-acetamido-1-[2-(3,5-dimethoxyanilino)-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-(3,5-dimethoxyanilino)-2-oxoethyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
ethyl 3-acetamido-1-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C794-1394 |
| Compound Name: | ethyl 3-acetamido-1-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C25 H29 N3 O6 S |
| Smiles: | CCOC(c1c(c2c3CCCCc3sc2n1CC(Nc1cc(cc(c1)OC)OC)=O)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5522 |
| logD: | 2.8696 |
| logSw: | -3.9836 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.099 |
| InChI Key: | RCKLTKREJJWILY-UHFFFAOYSA-N |