N-{3-[1-(3-nitrobenzoyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Chemical Structure Depiction of
N-{3-[1-(3-nitrobenzoyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
N-{3-[1-(3-nitrobenzoyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Compound characteristics
| Compound ID: | C327-0240 |
| Compound Name: | N-{3-[1-(3-nitrobenzoyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide |
| Molecular Weight: | 470.52 |
| Molecular Formula: | C21 H18 N4 O5 S2 |
| Smiles: | CS(Nc1cccc(c1)C1CC(c2cccs2)N(C(c2cccc(c2)[N+]([O-])=O)=O)N=1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7621 |
| logD: | 3.7389 |
| logSw: | -3.9597 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.382 |
| InChI Key: | JOHNGFFGUQKMET-LJQANCHMSA-N |