데이터를 보충하는 중입니다. 보통 1분 이내에 완료됩니다
기본 정보
- 표준 SMILES
Clc1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1N2- InChIKey
JNNOSTQEZICQQP-UHFFFAOYSA-N- 분자식
- C17H17ClN4
- 평균 분자량
- 312.804 g/mol
- 단동위원소 질량
- 312.11417422
이름 및 식별자
- 우선 이름
- N-Desmethylclozapine
- IUPAC
- 8-Chloro-11-(piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine
- 영어명
- N-Desmethylclozapine
- 분자식
- C17H17ClN4
- 분자량
- 312.8
이름 및 동의어
NORCLOZAPINEDesmethylclozapineNorclozapine (ACP-104)NormethylclozapineN-DesmethylclozapineClozapine EP IMpurity CClozapine Impurity C（EP）Norclozapine in methanolN-DesmethylclozapineD8-N-Desmethyl Clozapine HCL
데이터베이스 식별자
- CAS
6104-71-8- PubChem CID
- 135409468
- DTXSID
DTXSID0042616- ChEMBL
CHEMBL845- ChEBI
CHEBI:64050- UNII
- 1I9001LWY8
- EC Number
- 636-421-7
- Nikkaji
- J3.754.591K、J446.142H
물성
물리화학적 성질
- 녹는점
- 120 · 120-125°C
- 끓는 점
- 502.6 · 502.6±60.0 °C(Predicted)
- 밀도
- 1.38 · 1.38±0.1 g/cm3(Predicted)
- 인화점
- 9 ℃ · 9℃
- 저장 조건
- Store at RT
- 용해도
- 클로로포름(약간 용해됨), DMSO, 메탄올(약간 용해됨)
- 물리적 상태
- 노란색 고체.
- 산도 계수 (pKa)
- 8.49 · 8.49±0.10(Predicted)
- 색상
- 밝은 노란색에서 노란색까지
- InChI
- 1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
- InChIKey
- JNNOSTQEZICQQP-UHFFFAOYSA-N
- SMILES
- Clc1ccc2Nc3ccccc3C(=Nc2c1)N4CCNCC4
화학적 성질
Yellow Crystalline Solid
안전 및 규제
안전 데이터
- wgk
- 3
- ridadr
- 3249
- risk_code
- 20/22-36/37/38-39/23/24/25-23/24/25-11
- hazard_code
- Xn,T,F
- safety_code
- 22-36-45-36/37-16-7
- 포장분류
- III
- 위험 등급
- 6.1(b)
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도N-Desmethylclozapine has been used as standard to quantify the clozapine plasma levels in treatment-refractory Chinese schizophrenic patients.
일반 설명N-Desmethylclozapine is an active metabolite of Clozapine, an atypical antipsychotic drug used for treatment of schizophrenia. Clozapine is sold under the trade names Clozaril and FrazaClo in the US. This Certified Snap-N-Spike Solution is suitable for use in urine drug testing, clinical toxicology, forensic analysis, and clinical monitoring by LC-MS/MS or GC/MS.
상·하류 제품 정보
상류 원료
공급사50 곳
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Standardpharm Co. Ltd.86-714-3992388 · [email protected]
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추가 설명
정의ChEBI: A dibenzodoazepine substituted with chloro and piperazino groups which is a major metabolite of clozapine; a potent and selective 5-HT2C serotonin receptor antagonist.
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