기본 정보
- CAS
155488-25-8- 표준 SMILES
CNc1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1- InChIKey
YDZYKNJZCVIKPP-VWLOTQADSA-N- 분자식
- C28H30N6O3
- 평균 분자량
- 498.6 g/mol
- 단동위원소 질량
- 498.23793884
개요
Netazepide has been used in trials studying the prevention and treatment of Dyspepsia, Hypergastrinaemia, Barrett's Esophagus, ECL-cell Hyperplasia, and Rebound Hyperacidity, among others.
이름 및 식별자
- 우선 이름
- Netazepide
- IUPAC
- 1-[(3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl]-3-[3-(methylamino)phenyl]urea
- 영어명
- N-[(3R)-1-(3,3-Dimethyl-2-oxobutyl)-2,3-dihydro-2-oxo-5-(2-pyridinyl)-1H-1,4-benzodiazepin-3-yl]-N'-[3-(methylamino)phenyl]urea
- 분자식
- C28H30N6O3
- 분자량
- 498.58
이름 및 동의어
Sograzepidenetazepide155488-25-8YF-476YF476YF 476HOU4I0G29Cnetazepida1-((3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-(pyridin-2-yl)-2,3-dihydro-1h-1,4-benzodiazepin-3-yl)-3-(3-(methylamino)phenyl)ureaDTXSID00165906netazepidum1-((3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl)-3-(3-methylaminophenyl)urea
이름 더 보기
YM-220Estradiol-3-O-sulfamate1-[(3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl]-3-[3-(methylamino)phenyl]ureaN-[(3R)-1-(3,3-Dimethyl-2-oxobutyl)-2,3-dihydro-2-oxo-5-(2-pyridinyl)-1H-1,4-benzodiazepin-3-yl]-N'-[3-(methylamino)phenyl]ureaUrea, N-[(3R)-1-(3,3-dimethyl-2-oxobutyl)-2,3-dihydro-2-oxo-5-(2-pyridinyl)-1H-1,4-benzodiazepin-3-yl]-N'-[3-(methylamino)phenyl]-
1-[(3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylaminophenyl)ureaRefChem:165541DTXCID4088397Cholecystokinin B Receptor Antagonist YF4763-((3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-(pyridin-2-yl)-2,3-dihydro-1H-1,4-benzodiazepin-3-yl)-1-(3-(methylamino)phenyl)ureaNetazepide [INN]Sograzepide [INN]UNII-HOU4I0G29C
물성
구조 계산 물성
- XLogP
- 3.8
- 극성 표면적
- 116 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 868
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
LogP2.68
물리화학적 성질
- 끓는 점
- 723 · 723.0±60.0 °C(Predicted)
- 밀도
- 1.25 · 1.25
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- 100 mg/mL · DMSO : ≥ 100 mg/mL (200.57 mM)
- 산도 계수 (pKa)
- 11.38 · 11.38±0.40(Predicted)
- 물리적 상태
- Solid
- 색상
- Off-white to light yellow
화학 및 산업
응용 분야
용도Sograzepide is used in the treatment of gastric carcinoids or patients with chronic atrophic gastritis. Gastric receptor antagonist.
공급사21 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
安徽今昱生物化工产品技术研发有限公司055167162561 13295518198 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
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