기본 정보
- 표준 SMILES
COC(=O)C1=C(C)NC(C)=C(C(=O)OCCCN2CCC(c3ccccc3)(c3ccccc3)CC2)[C@@H]1c1cccc([N+](=O)[O-])c1- InChIKey
SVJMLYUFVDMUHP-MGBGTMOVSA-N- 분자식
- C36H39N3O6
- 평균 분자량
- 609.7 g/mol
- 단동위원소 질량
- 609.28388597
개요
(4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[3-(4,4-diphenyl-1-piperidinyl)propyl] ester O3-methyl ester is a diarylmethane.
이름 및 식별자
- 우선 이름
- (+)-Niguldipine
- IUPAC
- 5-O-[3-(4,4-diphenylpiperidin-1-yl)propyl] 3-O-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
- 현지명
- 덱스니굴디핀
- 영어명
- Dexniguldipine
- 분자식
- C36H39N3O6
- 분자량
- 609.71
이름 및 동의어
Dexniguldipine(R)-niguldipine120054-86-6(+)-NIGULDIPINEDexniguldipinoN9DG6ZTC43DTXSID70152666dexniguldipinumDexniguldipine.HClO3-(3-(4,4-di(phenyl)piperidin-1-yl)propyl) O5-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylateO3-[3-[4,4-di(phenyl)piperidin-1-yl]propyl] O5-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylateRefChem:905476
이름 더 보기
덱스니굴디핀(R)-Dexniguldipine(4R)-2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylic acid 3-methyl 5-[3-(4,4-diphenylpiperidino)propyl] ester(R)-1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 3-[3-(4,4-diphenylpiperidin-1-yl)propyl]-5-methyl ester3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-[3-(4,4-diphenyl-1-piperidinyl)propyl] 5-methyl ester, (4R)-
DTXCID90820572B859 35((-)-3-Methyl-5-3-(4,4-diphenyl-l-piperidinyl)-propyl-l,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-pyridine-3,5-dicarboxylate-hydrochloride)1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid, 3-(4,4-Diphenyl-1-piperidinyl)propyl Methyl Ester, Monohydrochloride (R)-3-(3-(4,4-diphenylpiperidin-1-yl)propyl) 5-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate(R)-Nigaldipine HydrochlorideDexniguldipine [INN]5-O-[3-(4,4-diphenylpiperidin-1-yl)propyl] 3-O-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
데이터베이스 식별자
- CAS
120054-86-6- PubChem CID
- 6918097
- DTXSID
DTXSID70152666- ChEMBL
CHEMBL2051956- ChEBI
CHEBI:103932- UNII
- N9DG6ZTC43
- Nikkaji
- J401.544D
물성
구조 계산 물성
- XLogP
- 6.8
- 극성 표면적
- 114 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 45
- 형식 전하
- 0
- 복잡도
- 1,100
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
Substances that inhibit or prevent the proliferation of NEOPLASMS.
A class of drugs that act by selective inhibition of calcium influx through cellular membranes.
공급사2 곳
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TargetMol中国(陶术生物)15002134094 · [email protected]
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