3-(4-bromophenyl)-1-(4-methylbenzene-1-sulfonyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazole
Chemical Structure Depiction of
3-(4-bromophenyl)-1-(4-methylbenzene-1-sulfonyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazole
3-(4-bromophenyl)-1-(4-methylbenzene-1-sulfonyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazole
Compound characteristics
| Compound ID: | 2799-0071 |
| Compound Name: | 3-(4-bromophenyl)-1-(4-methylbenzene-1-sulfonyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazole |
| Molecular Weight: | 500.37 |
| Molecular Formula: | C22 H18 Br N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1C(CC(c2ccc(cc2)[Br])=N1)c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0687 |
| logD: | 6.0687 |
| logSw: | -5.6688 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.733 |
| InChI Key: | ZJIICSOSGNTPRR-JOCHJYFZSA-N |