methyl 1,5-dimethyl-4-[(3-methylbutyl)sulfamoyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1,5-dimethyl-4-[(3-methylbutyl)sulfamoyl]-1H-pyrrole-2-carboxylate
methyl 1,5-dimethyl-4-[(3-methylbutyl)sulfamoyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F639-0108 |
| Compound Name: | methyl 1,5-dimethyl-4-[(3-methylbutyl)sulfamoyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 302.39 |
| Molecular Formula: | C13 H22 N2 O4 S |
| Smiles: | CC(C)CCNS(c1cc(C(=O)OC)n(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8803 |
| logD: | 1.8802 |
| logSw: | -2.5799 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.316 |
| InChI Key: | GGDCSEKXYRCEAO-UHFFFAOYSA-N |