ethyl 2-(2-formyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-formyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-formyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8018-6512 |
| Compound Name: | ethyl 2-(2-formyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 303.38 |
| Molecular Formula: | C16 H17 N O3 S |
| Smiles: | CCOC(c1c2CCCCc2sc1n1cccc1C=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7904 |
| logD: | 3.7904 |
| logSw: | -4.0598 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.67 |
| InChI Key: | UOXAUTLWKPQCRA-UHFFFAOYSA-N |