2-(3-{2-[5-(2,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
Chemical Structure Depiction of
2-(3-{2-[5-(2,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
2-(3-{2-[5-(2,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8006-2606 |
| Compound Name: | 2-(3-{2-[5-(2,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1) |
| Molecular Weight: | 724.44 |
| Molecular Formula: | C33 H21 Cl2 F N4 O3 S |
| Salt: | HBr |
| Smiles: | COc1ccc(cc1F)C1CC(c2ccc(cc2[Cl])[Cl])N(c2nc(cs2)c2cccc(c2)N2C(c3ccccc3C2=O)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 9.3108 |
| logD: | 9.3108 |
| logSw: | -6.3838 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.739 |
| InChI Key: | CVCRVRWOFASZLS-LJAQVGFWSA-N |