N-methyl-N-[(N''-nitrocarbamimidamido)methyl]benzenesulfonamide
Chemical Structure Depiction of
N-methyl-N-[(N''-nitrocarbamimidamido)methyl]benzenesulfonamide
N-methyl-N-[(N''-nitrocarbamimidamido)methyl]benzenesulfonamide
Compound characteristics
| Compound ID: | 5044-0025 |
| Compound Name: | N-methyl-N-[(N''-nitrocarbamimidamido)methyl]benzenesulfonamide |
| Molecular Weight: | 287.29 |
| Molecular Formula: | C9 H13 N5 O4 S |
| Smiles: | CN(CNC(\N)=N/[N+]([O-])=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2311 |
| logD: | -0.2311 |
| logSw: | -2.1255 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.186 |
| InChI Key: | IVMYBEAHQUZQNS-UHFFFAOYSA-N |