N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4-nitrobenzene-1-sulfonamide
N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y502-6770 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 392.82 |
| Molecular Formula: | C16 H13 Cl N4 O4 S |
| Smiles: | C(c1ccc(cc1)[Cl])n1cc(cn1)NS(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1401 |
| logD: | 1.4992 |
| logSw: | -3.563 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.775 |
| InChI Key: | WQZLORVTQNMLFO-UHFFFAOYSA-N |