主记录
M3 receptor antagonist 1
- CAS
- 1004312-94-0
- PubChem CID
- 23725115
- SMILES
- C1C[N+]2(CCC1[C@H](C2)OC(=O)N(CC3=CC(=C(C(=C3)F)F)F)C4=CC(=CC=C4)F)CC(=O)C5=CC=CS5.[Br-]
- 分子式
- C27H25BrF4N2O3S
- 分子量
- 613.471
- 精确分子量
- 612.0705
- InChI
- InChI=1S/C27H25F4N2O3S.BrH/c28-19-3-1-4-20(13-19)32(14-17-11-21(29)26(31)22(30)12-17)27(35)36-24-16-33(8-6-18(24)7-9-33)15-23(34)25-5-2-10-37-25;/h1-5,10-13,18,24H,6-9,14-16H2;1H/q+1;/p-1/t18?,24-,33?;/m0./s1
- InChIKey
- BDUVQZSIMOIWQB-JTOZIPDCSA-M
- LogP
- 2.9436
- TPSA
- 46.61
名称与别名
- M3 receptor antagonist 1
- CHF5407
- 1004312-94-0
- XG7DP88RRK
- orb1707763
- SCHEMBL3744347
- SCHEMBL29369370
- GLXC-05306
- CHF-5407
- EX-A15692
- HY-U00302
- AKOS040740978
- CS-7286
- DA-55137
- (3R)-3-[[[(3-Fluorophenyl)[(3,4,5-trifluorophenyl)methyl]amino]carbonyl]oxy]-1-[2-oxo-2-(2-thienyl)ethyl]-1-azoniabicyclo[2.2.2]octane bromide
- [(3R)-1-(2-oxo-2-thiophen-2-ylethyl)-1-azoniabicyclo[2.2.2]octan-3-yl] N-(3-fluorophenyl)-N-[(3,4,5-trifluorophenyl)methyl]carbamate;bromide
- (R)-3-(((3-Fluorophenyl)(3,4,5-trifluorobenzyl)carbamoyl)oxy)-1-(2-oxo-2-(thiophen-2-yl)ethyl)quinuclidin-1-ium bromide
- 1-Azoniabicyclo[2.2.2]octane, 3-[[[(3-fluorophenyl)[(3,4,5-trifluorophenyl)methyl]amino]carbonyl]oxy]-1-[2-oxo-2-(2-thienyl)ethyl]-, bromide, (3R)-
- 3-((((3-fluorophenyl)((3,4,5-trifluorophenyl)methyl)amino)carbonyl)oxy)-1-(2-oxo-2-(2-thienyl)ethyl)-1-azoniabicyclo(2.2.2)octane