3-methyl-1-(2-nitrobenzene-1-sulfonyl)-5-phenyl-4-(phenylsulfanyl)-1H-pyrazole
Chemical Structure Depiction of
3-methyl-1-(2-nitrobenzene-1-sulfonyl)-5-phenyl-4-(phenylsulfanyl)-1H-pyrazole
3-methyl-1-(2-nitrobenzene-1-sulfonyl)-5-phenyl-4-(phenylsulfanyl)-1H-pyrazole
Compound characteristics
| Compound ID: | 3339-1394 |
| Compound Name: | 3-methyl-1-(2-nitrobenzene-1-sulfonyl)-5-phenyl-4-(phenylsulfanyl)-1H-pyrazole |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C22 H17 N3 O4 S2 |
| Smiles: | Cc1c(c(c2ccccc2)n(n1)S(c1ccccc1[N+]([O-])=O)(=O)=O)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4854 |
| logD: | 4.4854 |
| logSw: | -4.4249 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.426 |
| InChI Key: | RQRGLHAQUVJSCE-UHFFFAOYSA-N |