(2R)-3-[[(3-bromophenyl)] [[3-(trifluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol

HCID 86586491

기본 정보

표준 SMILES
O[C@H](CN(Cc1cccc(OC(F)(F)F)c1)c1cccc(Br)c1)C(F)(F)F
InChIKey
XRIVZFQNQAJERJ-OAHLLOKOSA-N
분자식
C17H14BrF6NO2
평균 분자량
458.2 g/mol
단동위원소 질량
457.01121

이름 및 식별자

우선 이름
(2R)-3-[[(3-bromophenyl)] [[3-(trifluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol
IUPAC
(2R)-3-[3-bromo-N-[[3-(trifluoromethoxy)phenyl]methyl]anilino]-1,1,1-trifluoropropan-2-ol

이름 및 동의어

(2R)-3-[[(3-bromophenyl)] [[3-(trifluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanolSCHEMBL3281880(2R)-3-[[(3-bromophenyl) ][[3-(tri-fluoromethoxy)phenyl]methyl]amino]-1,1,1 -trifluoro-2-propanol(2R)-3-[[(3-bromophenyl)] [[3-(tri-fluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol(2R)-3-[[(3-bromophenyl)] [[3-(trifluoromethoxy)phenyl] methyl]amino]-1,1,1-trifluoro-2-propanol(2R)-3-[[(3-bromophenyl)][[3-(tri-fluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol(2R)-3-[[(3-bromophenyl)][[3-(trifluoromethoxy)phenyl] methyl]amino]-1,1,1-trifluoro-2-propanol(2R)-3-[[(3-bromophenyl)][[3-(trifluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol

데이터베이스 식별자

PubChem CID
86586491

물성

구조 계산 물성

XLogP
5.9
극성 표면적
32.7 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
9
회전 가능 결합 수
6
무거운 원자 수
27

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