6-{2-[(4-fluorophenyl)imino]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-3(2H)-yl}hexan-1-ol--hydrogen bromide (1/1)
Chemical Structure Depiction of
6-{2-[(4-fluorophenyl)imino]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-3(2H)-yl}hexan-1-ol--hydrogen bromide (1/1)
6-{2-[(4-fluorophenyl)imino]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-3(2H)-yl}hexan-1-ol--hydrogen bromide (1/1)
Compound characteristics
Compound ID: | 8009-1110 |
Compound Name: | 6-{2-[(4-fluorophenyl)imino]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-3(2H)-yl}hexan-1-ol--hydrogen bromide (1/1) |
Molecular Weight: | 584.57 |
Molecular Formula: | C25 H30 F N3 O3 S2 |
Salt: | HBr |
Smiles: | C(CCCO)CCN1C(=CSC/1=N/c1ccc(cc1)F)c1ccc(cc1)S(N1CCCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.9129 |
logD: | 4.9129 |
logSw: | -4.6631 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.286 |
InChI Key: | HHRIXZHSAXUAJX-RFBIWTDZSA-N |