ethyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y030-6199 |
| Compound Name: | ethyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 405.53 |
| Molecular Formula: | C20 H23 N O4 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1ccc(cc1OC)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7508 |
| logD: | -0.0495 |
| logSw: | -4.6391 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.429 |
| InChI Key: | PTZWXNYKLQLUDV-UHFFFAOYSA-N |