5-(2-nitrophenyl)-N,3-diphenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
5-(2-nitrophenyl)-N,3-diphenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
5-(2-nitrophenyl)-N,3-diphenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | 8018-2346 |
| Compound Name: | 5-(2-nitrophenyl)-N,3-diphenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C22 H18 N4 O2 S |
| Smiles: | C1C(c2ccccc2[N+]([O-])=O)N(C(Nc2ccccc2)=S)N=C1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4388 |
| logD: | 5.4388 |
| logSw: | -5.8721 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.445 |
| InChI Key: | DJTZIAJMJBLZNZ-NRFANRHFSA-N |