ethyl 2-[(2S)-2-(acetyloxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2S)-2-(acetyloxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(2S)-2-(acetyloxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V030-1199 |
| Compound Name: | ethyl 2-[(2S)-2-(acetyloxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C16 H21 N O5 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC([C@H](C)OC(C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8177 |
| logD: | 0.468 |
| logSw: | -3.1064 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.591 |
| InChI Key: | ZPGBJYSHPCYOJZ-VIFPVBQESA-N |