2-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}[1,3]thiazolo[5,4-b]pyridine
Chemical Structure Depiction of
2-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}[1,3]thiazolo[5,4-b]pyridine
2-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}[1,3]thiazolo[5,4-b]pyridine
Compound characteristics
| Compound ID: | L461-0269 |
| Compound Name: | 2-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}[1,3]thiazolo[5,4-b]pyridine |
| Molecular Weight: | 442.48 |
| Molecular Formula: | C18 H17 F3 N4 O2 S2 |
| Smiles: | C1CN(CCN(C1)S(c1cccc(c1)C(F)(F)F)(=O)=O)c1nc2cccnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0079 |
| logD: | 4.0078 |
| logSw: | -4.2674 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.482 |
| InChI Key: | MKJXVQYUDOKNSB-UHFFFAOYSA-N |