4,4,4-trifluoro-N-[1-(4-fluoro-3-propan-2-yloxyphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-3-(trifluoromethyl)but-2-enamide

HCID 74065112

기본 정보

표준 SMILES
CC(C)Oc1cc(C(Cc2ccccc2)(NC(=O)C=C(C(F)(F)F)C(F)(F)F)c2cc(F)cc(OC(F)(F)C(F)F)c2)ccc1F
InChIKey
QERQMDXZHWVNKE-UHFFFAOYSA-N
분자식
C30H23F12NO3
평균 분자량
673.5 g/mol
단동위원소 질량
673.1486315

이름 및 식별자

우선 이름
4,4,4-trifluoro-N-[1-(4-fluoro-3-propan-2-yloxyphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-3-(trifluoromethyl)but-2-enamide
IUPAC
4,4,4-trifluoro-N-[1-(4-fluoro-3-propan-2-yloxyphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-3-(trifluoromethyl)but-2-enamide

이름 및 동의어

SCHEMBL757939

데이터베이스 식별자

PubChem CID
74065112

물성

구조 계산 물성

XLogP
9.6
극성 표면적
47.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
15
회전 가능 결합 수
11
무거운 원자 수
46

관련 반응

2건

화합물 노트

불러오는 중…

4,4,4-trifluoro-N-[1-(4-fluoro-3-propan-2-yloxyphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-3-(trifluoromethyl)but-2-enamide (HCID 74065112)|Huagongshe