기본 정보
- CAS
737-86-0- 표준 SMILES
Cc1ncc(CO)c(C=NNC(=O)c2ccncc2)c1O- InChIKey
BQYIXOPJPLGCRZ-UHFFFAOYSA-N- 분자식
- C14H14N4O3
- 평균 분자량
- 286.29 g/mol
- 단동위원소 질량
- 286.10659032
개요
acts as iron chelating agent
이름 및 식별자
- 우선 이름
- Pyridoxal Isonicotinoyl Hydrazone
- IUPAC
- N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylideneamino]pyridine-4-carboxamide
- 현지명
- 피리독살이소니코티노일히드라존
- 영어명
- pyridoxal isonicotinoyl hydrazone
- 분자식
- C14H14N4O3
- 분자량
- 286.29
이름 및 동의어
DTXSID601032630NSC-77674RefChem:930363DTXCID2014696694-Pyridinecarboxylic acid, ((3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl)methylene)hydrazide737-86-0Isonicotinic acid, hydrazide, hydrazone with pyridoxalPyridoxal Isonicotinoyl HydrazoneXT2MSO57QWN'-((3-Hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl)methylene)isonicotinohydrazideN-[[3-Hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylideneamino]pyridine-4-carboxamideMFCD00763290
이름 더 보기
피리독살이소니코티노일히드라존NSC 77674PIH - CAS 737-86-0 - CalbiochemPyridoxal isonicotinoyl hydrazinePIH(Pyridoxal isonicotinoyl hydrazine)Pyridoxal isonicotinoyl hydrazone (PIH)PIH - CAS 737-86-0 - Calbiochem[528110]PIH - CAS 737-86-0 - Calbiochem[528110-50MG]inhibit,pyridoxal isonicotinoyl hydrazone,InhibitorPyridoxal isonicotinoyl hydrazone (PIH), hydrazone iron chelator
NSC 77674; PIHSCHEMBL6930377SCHEMBL25305111SCHEMBL29385000P3134F867520N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]pyridine-4-carbohydrazideN'-{[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene}pyridine-4-carbohydrazide
물성
구조 계산 물성
- XLogP
- -0.1
- 극성 표면적
- 108 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 371
실험 및 물리화학적 성질
LogP-1.89
물리화학적 성질
- 녹는점
- 261 · 261-262 °C (decomp)
- 밀도
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- 저장 조건
- 2 C · +2C to +8C
- 용해도
- 1 mg/ml; · DMF: 1 mg/ml; DMSO: 5 mg/ml; Ethanol: 0.5 mg/ml
- 물리적 상태
- 노란색 고체
- 산도 계수 (pKa)
- 8.04 · 8.04±0.10(Predicted)
- 색상
- yellow
- InChI
- 1S/C14H14N4O3/c1-9-13(20)12(11(8-19)6-16-9)7-17-18-14(21)10-2-4-15-5-3-10/h2-7,17,19H,8H2,1H3,(H,18,21)/b12-7+
- InChIKey
- HOYFGBFEIXEDEL-KPKJPENVSA-N
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- WGK 1
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Chemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS.
Organic chemicals that form two or more coordination links with an iron ion. Once coordination has occurred, the complex formed is called a chelate. The iron-binding porphyrin group of hemoglobin is an example of a metal chelate found in biological systems.
응용 분야
용도Pyridoxal Isonicotinoyl Hydrazone is a cell-permeable non-toxic iron chelator of the aroyl hydrazone class.
일반 설명A cell-permeable, non-toxic tridendate iron (Fe3+) chelator of the aroyl hydrazone class. Even at low concentrations, highly effective in mobilizing Fe3+ from cells and preventing its uptake from transferrin, even at low concentrations. Exhibits similar specificity and binding affinity as Deferoxamine Mesylate (Cat. No. 252750) but has greater access to mitochondrial iron. Also useful for the management of iron overload disease in experimental models. Inhibits the induction of heme containing indoleamine 2,3-dioxygenase activity.
공급사40 곳
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
上海康恩博科技有限公司（科小研试剂）400-1388-521 17673770086 · [email protected]
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