methyl 1-ethyl-4-[N-(4-fluorobenzene-1-sulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-[N-(4-fluorobenzene-1-sulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 1-ethyl-4-[N-(4-fluorobenzene-1-sulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V024-6227 |
| Compound Name: | methyl 1-ethyl-4-[N-(4-fluorobenzene-1-sulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 452.54 |
| Molecular Formula: | C22 H29 F N2 O5 S |
| Smiles: | CCn1c(C)c(C(CN(CC(C)C)S(c2ccc(cc2)F)(=O)=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9567 |
| logD: | 3.9567 |
| logSw: | -4.3447 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.758 |
| InChI Key: | CAUIGLWASQXLPE-UHFFFAOYSA-N |