N,N-diethyl-4-(3-[2-(4-sulfamoylphenyl)ethyl]-2-{[3-(trifluoromethyl)phenyl]imino}-2,3-dihydro-1,3-thiazol-4-yl)benzene-1-sulfonamide--hydrogen bromide (1/1)
Chemical Structure Depiction of
N,N-diethyl-4-(3-[2-(4-sulfamoylphenyl)ethyl]-2-{[3-(trifluoromethyl)phenyl]imino}-2,3-dihydro-1,3-thiazol-4-yl)benzene-1-sulfonamide--hydrogen bromide (1/1)
N,N-diethyl-4-(3-[2-(4-sulfamoylphenyl)ethyl]-2-{[3-(trifluoromethyl)phenyl]imino}-2,3-dihydro-1,3-thiazol-4-yl)benzene-1-sulfonamide--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8009-2766 |
| Compound Name: | N,N-diethyl-4-(3-[2-(4-sulfamoylphenyl)ethyl]-2-{[3-(trifluoromethyl)phenyl]imino}-2,3-dihydro-1,3-thiazol-4-yl)benzene-1-sulfonamide--hydrogen bromide (1/1) |
| Molecular Weight: | 719.66 |
| Molecular Formula: | C28 H29 F3 N4 O4 S3 |
| Salt: | HBr |
| Smiles: | CCN(CC)S(c1ccc(cc1)C1=CSC(=N/c2cccc(c2)C(F)(F)F)\N1CCc1ccc(cc1)S(N)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5127 |
| logD: | 5.5118 |
| logSw: | -5.5948 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.981 |
| InChI Key: | RHPRZWZZASYHNL-KGGMANCPSA-N |