기본 정보
- CAS
1285636-99-8- 표준 SMILES
CCOc1ccc(-c2cc(C(=O)N/N=C/c3ccc(O)c(OC)c3)n[nH]2)cc1OC- InChIKey
JRZXINKRNWCAQP-WSDLNYQXSA-N- 분자식
- C21H22N4O5
- 평균 분자량
- 410.4 g/mol
- 단동위원소 질량
- 410.15901982
이름 및 식별자
- 우선 이름
- (E)-3-(4-ethoxy-3-methoxyphenyl)-N'-(4-hydroxy-3-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide
- IUPAC
- 3-(4-ethoxy-3-methoxyphenyl)-N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
- 영어명
- (E)-3-(4-ethoxy-3-methoxyphenyl)-N-(4-hydroxy-3-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide
- 분자식
- C21H22N4O5
- 분자량
- 410.42
이름 및 동의어
1285636-99-8(E)-3-(4-ethoxy-3-methoxyphenyl)-N'-(4-hydroxy-3-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide3-(4-ethoxy-3-methoxyphenyl)-N'-[(1E)-(4-hydroxy-3-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide3-(4-ethoxy-3-methoxyphenyl)-N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamideMFCD02932123STK102859AKOS001641243ZINC000004677702ST50054275SR-01000110312SR-01000110312-1Z57099995
이름 더 보기
(E)-3-(4-ethoxy-3-methoxyphenyl)-N-(4-hydroxy-3-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide3-(4-ethoxy-3-methoxyphenyl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide3-(4-ethoxy-3-methoxyphenyl)-N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-1~{H}-pyrazole-5-carboxamide1H-Pyrazole-3-carboxylic acid, 5-(4-ethoxy-3-methoxyphenyl)-, (2E)-2-[(4-hydroxy-3-methoxyphenyl)methylene]hydrazide
F1092-2211CCOc1ccc(cc1OC)c1n(nH)c(c1)C(=O)NN=Cc1ccc(c(c1)OC)O(E)3(4ethoxy3methoxyphenyl)N(4hydroxy3methoxybenzylidene)1Hpyrazole5carbohydrazide3(4ethoxy3methoxyphenyl)N((E)(4hydroxy3methoxyphenyl)methylidene)1Hpyrazole5carbohydrazideN-[(1E)-2-(4-hydroxy-3-methoxyphenyl)-1-azavinyl][3-(4-ethoxy-3-methoxyphenyl) pyrazol-5-yl]carboxamide
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 118 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 578
물리화학적 성질
- 밀도
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.22 · 8.22±0.46(Predicted)
화학 및 산업
공급사1 곳
济南思考化学有限公司0531-0000 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…