N-methyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-methyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-4-nitrobenzene-1-sulfonamide
N-methyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y502-6842 |
| Compound Name: | N-methyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 310.33 |
| Molecular Formula: | C12 H14 N4 O4 S |
| Smiles: | CN(Cc1ccnn1C)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1503 |
| logD: | 1.1503 |
| logSw: | -2.4469 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.315 |
| InChI Key: | CDDUBURWDSKXPN-UHFFFAOYSA-N |