기본 정보
- CAS
318959-14-7- 표준 SMILES
Cc1nnc(-n2nccc2-c2cccc(Oc3ncc(C(F)(F)F)cc3Cl)c2)n1N- InChIKey
GXZFXZIZZRBMEK-UHFFFAOYSA-N- 분자식
- C18H13ClF3N7O
- 평균 분자량
- 435.8 g/mol
이름 및 식별자
- 우선 이름
- 3-[5-(3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine
- IUPAC
- 3-[5-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyrazol-1-yl]-5-methyl-1,2,4-triazol-4-amine
- 영어명
- 3-[5-(3-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy)phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine
- 분자식
- C18H13ClF3N7O
- 분자량
- 435.79
이름 및 동의어
318959-14-73-[5-(3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine3-[5-(3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine3-[5-[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]pyrazol-1-yl]-5-methyl-1,2,4-triazol-4-amine3-(5-(3-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)oxy)phenyl)-1H-pyrazol-1-yl)-5-methyl-4H-1,2,4-triazol-4-amineAKOS0050957526K-0563-[5-(3-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy)phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine4H-1,2,4-Triazol-4-amine, 3-[5-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-1H-pyrazol-1-yl]-5-methyl-3-[5-(3-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY)PHENYL)-1H-PYRAZOL-1-YL]-5-METHYL-4H-1,2,4-TRIAZOL-4-YLAMINE
데이터베이스 식별자
- CAS
318959-14-7
물성
구조 계산 물성
- XLogP
- 3.8
- 극성 표면적
- 96.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 588
화학 및 산업
공급사2 곳
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
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