ethyl 4-{N-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{N-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{N-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V010-4553 |
| Compound Name: | ethyl 4-{N-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 486.56 |
| Molecular Formula: | C25 H27 F N2 O5 S |
| Smiles: | CCOC(c1c(C)c(C(CN(Cc2ccc(cc2)F)S(c2ccccc2)(=O)=O)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7807 |
| logD: | 3.7807 |
| logSw: | -4.1654 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.151 |
| InChI Key: | BDUULSXYVRJOLZ-UHFFFAOYSA-N |