기본 정보
- CAS
1308256-94-1- 표준 SMILES
CCOC(=O)[C@H](C)N[C@@H](Cc1ccc(-c2cccc(Cl)c2)cc1)C(=O)O- InChIKey
PWYAUIUPDMSWJH-CODVNQPLNA-N- 분자식
- C20H22ClNO4
- 평균 분자량
- 375.8 g/mol
이름 및 식별자
- 우선 이름
- (S)-3-(3'-Chloro-[1,1'-biphenyl]-4-yl)-2-(((S)-1-ethoxy-1-oxopropan-2-yl)amino)propanoic acid
- IUPAC
- (2S)-3-[4-(3-chlorophenyl)phenyl]-2-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]propanoic acid
- 영어명
- LHW090-A7
- 분자식
- C20H22ClNO4
- 분자량
- 375.85
이름 및 동의어
1308256-94-1LHW090-A7(S)-3-(3'-Chloro-[1,1'-biphenyl]-4-yl)-2-(((S)-1-ethoxy-1-oxopropan-2-yl)amino)propanoic acidLHW090-a7 acidRUQ5JTB7HRUNII-RUQ5JTB7HR(2S)-3-[4-(3-chlorophenyl)phenyl]-2-[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]propanoic acid(1,1'-Biphenyl)-4-propanoic acid, 3'-chloro-alpha-(((1S)-2-ethoxy-1-methyl-2-oxoethyl)amino)-, (alphaS)-(alphaS)-3'-Chloro-alpha-(((1S)-2-ethoxy-1-methyl-2-oxoethyl)amino)(1,1'-biphenyl)-4-propanoic acid[1,1'-Biphenyl]-4-propanoic acid, 3'-chloro-alpha-[[(1S)-2-ethoxy-1-methyl-2-oxoethyl]amino]-, (alphaS)-(2S)-3-[4-(3-chlorophenyl)phenyl]-2-{[(2S)-1-ethoxy-1-oxopropan-2-yl]amino}propanoic acidorb1220082
이름 더 보기
CS-2208EOS-61103LHW090 A7,LHW-090-A7,LHW090A7(αS)-3'-Chloro-α-[[(1S)-2-ethoxy-1-methyl-2-oxoethyl]amino][1,1'-biphenyl]-4-propanoic acid(2S)-3-{3'-chloro-[1,1'-biphenyl]-4-yl}-2-{[(2S)-1-ethoxy-1-oxopropan-2-yl]amino}propanoic acid[1,1'-Biphenyl]-4-propanoic acid, 3'-chloro-α-[[(1S)-2-ethoxy-1-methyl-2-oxoethyl]amino]-, (αS)-
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 75.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 465
물리화학적 성질
- 용해도
- 5 mg/mlEthanol: · DMSO: 5 mg/mlEthanol: 1 mg/mlPBS (pH 7.2): 10 mg/ml
- InChI
- InChI=1/C20H22ClNO4/c1-3-26-20(25)13(2)22-18(19(23)24)11-14-7-9-15(10-8-14)16-5-4-6-17(21)12-16/h4-10,12-13,18,22H,3,11H2,1-2H3,(H,23,24)/t13-,18-/s3
- InChIKey
- PWYAUIUPDMSWJH-CODVNQPLNA-N
- SMILES
- C(O)(=O)[C@@H](N[C@@H](C)C(OCC)=O)CC1=CC=C(C2=CC=CC(Cl)=C2)C=C1 |&1:3,5,r|
화학 및 산업
응용 분야
개요LHW090-A7 is a compound developed as an inhibitor of neutral endopeptidase (NEP), an enzyme responsible for the metabolic inactivation of enkephalins. Inhibitors of NEP have been shown to increase plasma levels of endogenous atrial natriuretic peptides and, as such, are expected to induce natriuretic and diuretic effects.
공급사38 곳
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
Nantong HI-FUTURE Biology Co., Ltd.+86-18051384581 · [email protected]
上海波以尔化工有限公司[email protected]
InvivoChem中国13549236410 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
上海瀚香生物科技有限公司177-54423994 17754423994 · [email protected]
上海琅迪信息科技中心13816752554 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
南京百鑫德诺生物科技有限公司025-58849295 · [email protected]
관련 반응
9건
화합물 노트
불러오는 중…