3-chloro-1-(2-chlorophenyl)-4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1H-pyrrole-2,5-dione--hydrogen chloride (1/2)
Chemical Structure Depiction of
3-chloro-1-(2-chlorophenyl)-4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1H-pyrrole-2,5-dione--hydrogen chloride (1/2)
3-chloro-1-(2-chlorophenyl)-4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1H-pyrrole-2,5-dione--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | 4112-3760 |
| Compound Name: | 3-chloro-1-(2-chlorophenyl)-4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1H-pyrrole-2,5-dione--hydrogen chloride (1/2) |
| Molecular Weight: | 516.21 |
| Molecular Formula: | C21 H16 Cl2 N4 O3 |
| Salt: | 2HCl |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC1=C(C(N(C1=O)c1ccccc1[Cl])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1341 |
| logD: | -1.0659 |
| logSw: | -2.9166 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.343 |
| InChI Key: | HGMKIEWRWGHMGW-UHFFFAOYSA-N |