methyl 4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
methyl 4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G070-1506 |
| Compound Name: | methyl 4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C19 H25 N3 O4 S |
| Smiles: | Cn1cc(cc1C(=O)OC)S(NCCCN1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9439 |
| logD: | 1.161 |
| logSw: | -2.7502 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.966 |
| InChI Key: | RRTCVWZMEKZODD-UHFFFAOYSA-N |