methyl 4-{N-(benzenesulfonyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(benzenesulfonyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(benzenesulfonyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V009-3178 |
| Compound Name: | methyl 4-{N-(benzenesulfonyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C21 H22 N2 O6 S |
| Smiles: | Cc1c(C(CN(Cc2ccco2)S(c2ccccc2)(=O)=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9611 |
| logD: | 2.9611 |
| logSw: | -3.4405 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.493 |
| InChI Key: | JCQAESPTTXTYDZ-UHFFFAOYSA-N |