CAS 83435-67-0 Delapril Hydrochloride (HCID 5362115)

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기본 정보

CAS: 83435-67-0
표준 SMILES: CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N(CC(=O)O)C1Cc2ccccc2C1.Cl
InChIKey: FDJCVHVKXFIEPJ-JCNFZFLDSA-N
분자식: C26H33ClN2O5
평균 분자량: 489 g/mol
단동위원소 질량: 488.2077999

개요

Delapril hydrochloride is a peptide.

이름 및 식별자

우선 이름: Delapril Hydrochloride
IUPAC: 2-[2,3-dihydro-1H-inden-2-yl-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]amino]acetic acid;hydrochloride
영어명: DELAPRIL HCL
분자식: C26H32N2O5.HCl
분자량: 0

이름 및 동의어

delapril hydrochloride83435-67-0Delapril HClAdecutREV 6000ACCRIS 1925DTXSID6048597REV-6000A2SMM3M5ZMHDelapril hydrochloride [USAN:JAN]Adecut (TN)DTXCID6028523

이름 더 보기

CV 3317DefolderCupressinDalapril HclDELAPRIL HCL USP/EP/BPDelaprilHydrochloride>

DELAPRIL HYDROCHLORIDE [MI]DELAPRIL HYDROCHLORIDE [JAN]DELAPRIL HYDROCHLORIDE [USAN]N-(N-((S)-1-Ethoxycarbonyl-3-phenylpropyl)-L-alanyl)-N-(indan-2-yl)glycine hydrochlorideDELAPRIL HYDROCHLORIDE [MART.]DELAPRIL HYDROCHLORIDE [WHO-DD]Ethyl (S)-2-(((S)-1-((carboxymethyl)-2-indanylcarbamoyl)ethyl)amino)-4-phenylbutyrate, monohydrochlorideGlycine, N-((1S)-1-(ethoxycarbonyl)-3-phenylpropyl)-L-alanyl-N-(2,3-dihydro-1H-inden-2-yl)-, monohydrochloride

데이터베이스 식별자

CAS: 83435-67-0
PubChem CID: 5362115
DTXSID: DTXSID6048597
ChEMBL: CHEMBL2106126
ChEBI: CHEBI:31462
UNII

물성

구조 계산 물성

극성 표면적: 95.9 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 6
회전 가능 결합 수: 12
무거운 원자 수: 34
형식 전하: 0
복잡도: 649

물리화학적 성질

녹는점: 166 · 166-170℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 174 · DMSO:174.0(Max Conc. mg/mL);355.82(Max Conc. mM)
물리적 상태: Solid
색상: White to off-white
InChIKey: FDJCVHVKXFIEPJ-YSHIOSSBNA-N
SMILES: C1(CC2C=CC=CC=2C1)N(CC(=O)O)C(=O)[C@H](C)N[C@H](C(=O)OCC)CCC1=CC=CC=C1.Cl |&1:16,19,r|

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P203, P264, P270, P280, P301+P316, P318, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (33.3%)

안전 데이터

rtecs: MB9668000
Hazard Classifications: Acute Tox. 3 Oral
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야 · 2건

개요Delapril is a new angiotensin-converting enzyme (ACE) inhibitor useful in the treatment of essential hypertension. Orally administered delapril is a prodrug which is de-esterified to its active diacid metabolite. In hypertensive patients delapril significantly decreased systolic blood pressure and ACE activity 24 hours after dosing without affecting endogeneous creatinine clearance.

용도Antihypertensive; enzyme inhibitor (angiotensinconverting).

공급사56 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

咸宁深蓝生物医药研发有限公司18171815831 · [email protected]

普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]

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