3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8009-1076 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1) |
| Molecular Weight: | 583.44 |
| Molecular Formula: | C26 H22 F4 N2 O2 S |
| Salt: | HBr |
| Smiles: | COc1ccc(CCN2C(=CSC/2=N/c2cccc(c2)C(F)(F)F)c2ccc(cc2)F)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.774 |
| logD: | 6.7737 |
| logSw: | -6.0195 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.5424 |
| InChI Key: | ZZXFFKQHOYAVMD-GDWJVWIDSA-N |