主记录
IDWXJDPPEWUACA-UHFFFAOYSA-N
- CAS
- 816463-39-5
- PubChem CID
- 58807286
- SMILES
- CC1(COC1)COC2=CC3=C(C=C2)N(C=N3)C4=NC5=C(C=CC=C5OS(=O)(=O)C(F)(F)F)C=C4
- 分子式
- C22H18F3N3O5S
- 分子量
- 493.463
- 精确分子量
- 493.0919
- InChI
- InChI=1S/C22H18F3N3O5S/c1-21(10-31-11-21)12-32-15-6-7-17-16(9-15)26-13-28(17)19-8-5-14-3-2-4-18(20(14)27-19)33-34(29,30)22(23,24)25/h2-9,13H,10-12H2,1H3
- InChIKey
- IDWXJDPPEWUACA-UHFFFAOYSA-N
- LogP
- 4.2174
- TPSA
- 92.54
名称与别名
- IDWXJDPPEWUACA-UHFFFAOYSA-N
- SCHEMBL4682250
- SCHEMBL29450836
- 2-(5-((3-methyloxetan-3-yl)methoxy)-1H-benzo[d]imidazol-1-yl)quinolin-8-yl trifluoromethanesulfonate
- 816463-39-5
- N13358
- 2-{5-[(3-methyloxetan-3-yl)methoxy]-1H-1,3-benzodiazol-1-yl}quinolin-8-yl trifluoromethanesulfonate
- 2-(5-((3-methyloxetan-3-yl)methoxy)-1H-benzo[d]imidazol-1-yl)quinolin-8-yltrifluoromethanesulfonate
- 2-{5-[(3-methyloxetan-3-yl)methoxy]-1,3-benzodiazol-1-yl}quinolin-8-yl trifluoromethanesulfonate
- trifluoro-methanesulfonic acid 2-[5-(3-methyl-oxetan-3-ylmethoxy)-benzoimidazol-1-yl]-quinolin-8-yl ester