ethyl 3-acetamido-1-[2-(5-chloro-2-methoxyanilino)-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-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
ethyl 3-acetamido-1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C794-1398 |
| Compound Name: | ethyl 3-acetamido-1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate |
| Molecular Weight: | 504 |
| Molecular Formula: | C24 H26 Cl N3 O5 S |
| Smiles: | CCOC(c1c(c2c3CCCCc3sc2n1CC(Nc1cc(ccc1OC)[Cl])=O)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.666 |
| logD: | 2.9834 |
| logSw: | -4.1948 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.944 |
| InChI Key: | SNGYJNPQZOWYMG-UHFFFAOYSA-N |