N-{4-[(5-methyl-1,3,5-triazinan-2-ylidene)sulfamoyl]phenyl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{4-[(5-methyl-1,3,5-triazinan-2-ylidene)sulfamoyl]phenyl}-4-nitrobenzamide
N-{4-[(5-methyl-1,3,5-triazinan-2-ylidene)sulfamoyl]phenyl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 4877-0184 |
| Compound Name: | N-{4-[(5-methyl-1,3,5-triazinan-2-ylidene)sulfamoyl]phenyl}-4-nitrobenzamide |
| Molecular Weight: | 418.43 |
| Molecular Formula: | C17 H18 N6 O5 S |
| Smiles: | CN1CNC(NC1)=NS(c1ccc(cc1)NC(c1ccc(cc1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2498 |
| logD: | 0.3122 |
| logSw: | -2.6032 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 120.136 |
| InChI Key: | AGDMHKXLKIGKCR-UHFFFAOYSA-N |