methyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)(methyl)sulfamoyl]-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)(methyl)sulfamoyl]-1-methyl-1H-pyrrole-2-carboxylate
methyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)(methyl)sulfamoyl]-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-3572 |
| Compound Name: | methyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)(methyl)sulfamoyl]-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 423.44 |
| Molecular Formula: | C18 H21 N3 O7 S |
| Smiles: | CN(CC(NCc1ccc2c(c1)OCO2)=O)S(c1cc(C(=O)OC)n(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7619 |
| logD: | 0.7619 |
| logSw: | -2.521 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.873 |
| InChI Key: | LCLKZLBUINEYCG-UHFFFAOYSA-N |