ethyl 3-amino-4-(4-fluorobenzene-1-sulfonyl)-5-(methylsulfanyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-amino-4-(4-fluorobenzene-1-sulfonyl)-5-(methylsulfanyl)-1H-pyrrole-2-carboxylate
ethyl 3-amino-4-(4-fluorobenzene-1-sulfonyl)-5-(methylsulfanyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C201-0790 |
| Compound Name: | ethyl 3-amino-4-(4-fluorobenzene-1-sulfonyl)-5-(methylsulfanyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 358.41 |
| Molecular Formula: | C14 H15 F N2 O4 S2 |
| Smiles: | CCOC(c1c(c(c([nH]1)SC)S(c1ccc(cc1)F)(=O)=O)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.179 |
| logD: | 2.179 |
| logSw: | -2.6851 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.415 |
| InChI Key: | VZUZJZUFZPZGHM-UHFFFAOYSA-N |