3-[[3-(4-Fluorophenoxy)phenyl][[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol

HCID 10229808

기본 정보

표준 SMILES
OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(F)cc2)c1)C(F)(F)F
InChIKey
ZHUQKYBEVUVRAV-UHFFFAOYSA-N
분자식
C24H19F8NO3
평균 분자량
521.4 g/mol

이름 및 식별자

우선 이름
3-[[3-(4-Fluorophenoxy)phenyl][[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol
IUPAC
1,1,1-trifluoro-3-[3-(4-fluorophenoxy)-N-[[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]anilino]propan-2-ol

이름 및 동의어

CHEMBL713333-[[3-(4-fluorophenoxy)phenyl][[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanolSCHEMBL992839BDBM501281411,1,1-trifluoro-3-((3-(4-fluorophenoxy)phenyl)(3-(1,1,2,2-tetrafluoroethoxy)benzyl)amino)propan-2-ol1,1,1-Trifluoro-3-{[3-(4-fluoro-phenoxy)-phenyl]-[3-(1,1,2,2-tetrafluoro-ethoxy)-benzyl]-amino}-propan-2-ol3-[[3-(4-fluorophenoxy)phenyl][[3-(1,1,2,2-tetrafluoro-ethoxy)phenyl]methyl] amino]-1,1,1-trifluoro-2-propanol3-[[3-(4-fluorophenoxy)phenyl][[3-(1,1,2,2-tetrafluoro-ethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol

데이터베이스 식별자

PubChem CID
10229808
ChEMBL
CHEMBL71333

물성

구조 계산 물성

XLogP
7.3
극성 표면적
41.9 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
12
회전 가능 결합 수
10
무거운 원자 수
36

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