methyl 4-{[3-(azepan-1-yl)butyl]sulfamoyl}-1,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[3-(azepan-1-yl)butyl]sulfamoyl}-1,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{[3-(azepan-1-yl)butyl]sulfamoyl}-1,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F639-0346 |
| Compound Name: | methyl 4-{[3-(azepan-1-yl)butyl]sulfamoyl}-1,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 385.52 |
| Molecular Formula: | C18 H31 N3 O4 S |
| Smiles: | CC(CCNS(c1cc(C(=O)OC)n(C)c1C)(=O)=O)N1CCCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8663 |
| logD: | -0.6536 |
| logSw: | -2.5034 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.016 |
| InChI Key: | JINDEILSMMSLNJ-AWEZNQCLSA-N |