N,N-dibenzyl-2-({3-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenoxy]-2-hydroxypropyl}sulfamoyl)benzamide
Chemical Structure Depiction of
N,N-dibenzyl-2-({3-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenoxy]-2-hydroxypropyl}sulfamoyl)benzamide
N,N-dibenzyl-2-({3-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenoxy]-2-hydroxypropyl}sulfamoyl)benzamide
Compound characteristics
| Compound ID: | 2995-1360 |
| Compound Name: | N,N-dibenzyl-2-({3-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenoxy]-2-hydroxypropyl}sulfamoyl)benzamide |
| Molecular Weight: | 679.79 |
| Molecular Formula: | C38 H37 N3 O7 S |
| Smiles: | C1C=CCC2C1C(N(C2=O)c1ccc(cc1)OCC(CNS(c1ccccc1C(N(Cc1ccccc1)Cc1ccccc1)=O)(=O)=O)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2382 |
| logD: | 4.2375 |
| logSw: | -4.2172 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.888 |
| InChI Key: | KPMYLGVEJPVTGV-UHFFFAOYSA-N |