3-{4-[4-(pyrrolidine-1-sulfonyl)phenyl]-2-{[4-(trifluoromethoxy)phenyl]imino}-1,3-thiazol-3(2H)-yl}propan-1-ol--hydrogen bromide (1/1)
Chemical Structure Depiction of
3-{4-[4-(pyrrolidine-1-sulfonyl)phenyl]-2-{[4-(trifluoromethoxy)phenyl]imino}-1,3-thiazol-3(2H)-yl}propan-1-ol--hydrogen bromide (1/1)
3-{4-[4-(pyrrolidine-1-sulfonyl)phenyl]-2-{[4-(trifluoromethoxy)phenyl]imino}-1,3-thiazol-3(2H)-yl}propan-1-ol--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8009-8566 |
| Compound Name: | 3-{4-[4-(pyrrolidine-1-sulfonyl)phenyl]-2-{[4-(trifluoromethoxy)phenyl]imino}-1,3-thiazol-3(2H)-yl}propan-1-ol--hydrogen bromide (1/1) |
| Molecular Weight: | 608.5 |
| Molecular Formula: | C23 H24 F3 N3 O4 S2 |
| Salt: | HBr |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)C1=CSC(=N/c2ccc(cc2)OC(F)(F)F)/N1CCCO)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9281 |
| logD: | 4.9279 |
| logSw: | -4.7525 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.222 |
| InChI Key: | CKFVXXRBUFJXGU-HPNDGRJYSA-N |