methyl 4-[N-(3-ethoxypropyl)-N-(4-fluorobenzene-1-sulfonyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(3-ethoxypropyl)-N-(4-fluorobenzene-1-sulfonyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(3-ethoxypropyl)-N-(4-fluorobenzene-1-sulfonyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V031-0647 |
| Compound Name: | methyl 4-[N-(3-ethoxypropyl)-N-(4-fluorobenzene-1-sulfonyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 468.54 |
| Molecular Formula: | C22 H29 F N2 O6 S |
| Salt: | not_available |
| Smiles: | CCOCCCN(CC(c1c(C)c(C(=O)OC)n(C)c1C)=O)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.602 |
| logD: | 2.602 |
| logSw: | -2.766 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.799 |
| InChI Key: | WXLHEBHENHHQLP-UHFFFAOYSA-N |