N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methyl-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methyl-3-nitrobenzene-1-sulfonamide
N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methyl-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y509-3518 |
| Compound Name: | N-[(4,5-dichloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-methyl-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 379.22 |
| Molecular Formula: | C12 H12 Cl2 N4 O4 S |
| Smiles: | CN(Cc1c(c(n(C)n1)[Cl])[Cl])S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2599 |
| logD: | 2.2599 |
| logSw: | -3.4187 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.094 |
| InChI Key: | KOVQXXYUGZVWGC-UHFFFAOYSA-N |