1-(3-chloro-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-4-piperidinecarbohydrazide
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기본 정보
- CAS
444151-84-2- 표준 SMILES
CN(NC(=O)C1CCN(C2=C(Cl)C(=O)c3ccccc3C2=O)CC1)c1ncc(C(F)(F)F)cc1Cl- InChIKey
XADNUZJZOZVNOH-UHFFFAOYSA-N- 분자식
- C23H19Cl2F3N4O3
- 평균 분자량
- 527.3 g/mol
이름 및 식별자
- 우선 이름
- 1-(3-chloro-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-4-piperidinecarbohydrazide
- IUPAC
- 1-(3-chloro-1,4-dioxonaphthalen-2-yl)-N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methylpiperidine-4-carbohydrazide
- 영어명
- 1-(3-Chloro-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-4-piperidinecarbohydrazide
- 분자식
- C23H19Cl2F3N4O3
- 분자량
- 527.32
이름 및 동의어
444151-84-21-(3-chloro-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-4-piperidinecarbohydrazide1-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N'-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N'-methylpiperidine-4-carbohydrazide1-(3-chloro-1,4-dioxonaphthalen-2-yl)-N'-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N'-methylpiperidine-4-carbohydrazide1-(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N'-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-N'-methylpiperidine-4-carbohydrazideAKOS0050935804T-03144-Piperidinecarboxylic acid, 1-(3-chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-, 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-methylhydrazide
데이터베이스 식별자
- CAS
444151-84-2
물성
구조 계산 물성보충 중
- XLogP
- 5.2
- 극성 표면적
- 82.6 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 892
물리화학적 성질
- 밀도
- 1.54 · 1.54±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 11.19 · 11.19±0.20(Predicted)
관련 반응
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