기본 정보
- CAS
73080-51-0- 표준 SMILES
Cc1ccc2c([nH]c(=O)c3c(=O)cc(C(=O)OCCC(C)C)oc32)c1C- InChIKey
NFQIAEMCQGTTIR-UHFFFAOYSA-N- 분자식
- C20H21NO5
- 평균 분자량
- 355.4 g/mol
- 단동위원소 질량
- 355.14197277
개요
Repirinast is an organic molecular entity.
이름 및 식별자
- 우선 이름
- Repirinast
- IUPAC
- 3-methylbutyl 7,8-dimethyl-4,5-dioxo-6H-pyrano[3,2-c]quinoline-2-carboxylate
- 영어명
- Repirinast
- 분자식
- C20H21NO5
- 분자량
- 355.38
이름 및 동의어
repirinast73080-51-0MY-5116Repirinastum4K8KA8B61GDTXSID10223349Isoamyl 5,6-dihydro-7,8-dimethyl-4,5-dioxo-4H-pyrano(3,2-c)quinoline-2-carboxylateRefChem:930657DTXCID60145840RometIsopentyl 7,8-dimethyl-4,5-dioxo-5,6-dihydro-4H-pyrano[3,2-c]quinoline-2-carboxylate3-methylbutyl 7,8-dimethyl-4,5-dioxo-6H-pyrano[3,2-c]quinoline-2-carboxylate
이름 더 보기
RepirinasRui Pi Si TeRepirinast (>Repirinast (>80%)Repirinast USP/EP/BP3-Methylbutyl 7,8-dimethyl-4,5-dioxo-6H-pyrano[5,6-c]quinoline-2-carboxylate
Repirinast (>80%)Repirinastum [INN-Latin]Repirinast [USAN:INN:JAN]BRN 4267921UNII-4K8KA8B61GRomet (TN)REPIRINAST [MI]REPIRINAST [INN]
데이터베이스 식별자
- CAS
73080-51-0- PubChem CID
- 5050
- DTXSID
DTXSID10223349- ChEMBL
CHEMBL2105300- ChEBI
CHEBI:32092- UNII
- 4K8KA8B61G
- Nikkaji
- J22.795A
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 81.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 690
물리화학적 성질
- 녹는점
- 236 · 236-241°
- 끓는 점
- 488.42 °C · 488.42°C (rough estimate)
- 밀도
- 1.2749 · 1.2749 (rough estimate)
- 굴절률
- 1.6 · 1.6000 (estimate)
- 저장 조건
- 2 · 2-8°C
- 용해도
- DMSO(약간 용해됨, 가열), 메탄올(약간 용해됨, 가열)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 10.09 · 10.09±0.40(Predicted)
- 색상
- 흰색에서 황백색까지
- 수용성
- 1.2 mg/L · 1.2mg/L(온도는 명시되지 않음)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- 독성
- LD50 in rats, mice (mg/kg): >5000 orally, >5000 s.c. both species (Nagase)
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists. Classical antihistaminics block the histamine H1 receptors only.
Agents that suppress immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-CELLS or by inhibiting the activation of HELPER CELLS. While immunosuppression has been brought about in the past primarily to prevent rejection of transplanted organs, new applications involving mediation of the effects of INTERLEUKINS and other CYTOKINES are emerging.
응용 분야
개요Repirinast is an orally-active antiallergic agent useful in the treatment of allergic asthma. Its activity is reportedly attributed to a metabolite, the corresponding free acid (MY-1250), which is 17 times more potent than disodium cromoglycate in inhibiting histamine release due to antigen-antibody reactions.
용도Antiallergic.
상·하류 제품 정보
상류 원료
공급사37 곳
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