기본 정보
- CAS
324523-20-8- 표준 SMILES
CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1cccc(Cl)c1C#N.Cl- InChIKey
ZEBNDUQLNGYBNL-VEIFNGETSA-N- 분자식
- C24H26Cl2N2O2
- 평균 분자량
- 445.4 g/mol
- 단동위원소 질량
- 444.1371335
이름 및 식별자
- 우선 이름
- NPS-2143 hydrochloride
- IUPAC
- 2-chloro-6-[(2R)-2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]benzonitrile;hydrochloride
- 영어명
- 2-Chloro-6-[(2R)-3-[[1,1-dimethyl-2-(2-naphthalenyl)ethyl]amino]-2-hydroxypropoxy]benzonitrile hydrochloride
- 분자식
- C24H26Cl2N2O2
- 분자량
- 445.38
이름 및 동의어
324523-20-8NPS-2143 hydrochlorideSB-262470 hydrochlorideU48SZ6EBB3Benzonitrile, 2-chloro-6-((2R)-3-((1,1-dimethyl-2-(2-naphthalenyl)ethyl)amino)-2-hydroxypropoxy)-, hydrochloride (1:1)Benzonitrile, 2-chloro-6-((2R)-3-((1,1-dimethyl-2-(2-naphthalenyl)ethyl)amino)-2-hydroxypropoxy)-, monohydrochlorideRefChem:202326NPS 2143 hydrochlorideNPS-2143 HCLNPS-2143 (hydrochloride)(R)-2-Chloro-6-(2-hydroxy-3-((2-methyl-1-(naphthalen-2-yl)propan-2-yl)amino)propoxy)benzonitrile hydrochlorideCHEMBL2112075
이름 더 보기
2NPS 2143NPS-2143 (Mono HCl)NPS2143NPS 2143 HCLSB-262470-A hydrochlorideNPS2143 hydrochloride, >=98%NPS-2143/SB-262470A hydrochloride)NPS-2143 hydrochloride (SB-262470A)NPS-2143 hydrochloride, 10 mM in DMSONPS 2143 hydrochloride, Ca2+-sensing receptor antagonist
2-chloro-6-[(2R)-2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]benzonitrile;hydrochloride2-chloro-6-[(2R)-2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]benzonitrile hydrochlorideC24H26Cl2N2O2NPS-2143hydrochlorideUNII-U48SZ6EBB3EX-A017Aorb1302409SCHEMBL29901576
데이터베이스 식별자
- CAS
324523-20-8- PubChem CID
- 9868131
- ChEMBL
CHEMBL2112075- UNII
- U48SZ6EBB3
- EC Number
- 803-657-9
물성
구조 계산 물성
- 극성 표면적
- 65.3 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 560
물리화학적 성질
- 저장 조건
- 2 · 2-8°C
- 용해도
- 10 mg/mL · DMSO: >10mg/mL
- 물리적 상태
- 가루
- 색상
- 흰색에서 베이지색
- InChI
- 1S/C24H25ClN2O2.ClH/c1-24(2,13-17-10-11-18-6-3-4-7-19(18)12-17)27-15-20(28)16-29-23-9-5-8-22(25)21(23)14-26;/h3-12,20,27-28H,13,15-16H2,1-2H3;1H/t20-;/m1./s1
- InChIKey
- ZEBNDUQLNGYBNL-VEIFNGETSA-N
- SMILES
- Cl.CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc3cccc(Cl)c3C#N
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- wgk
- 3
- ridadr
- UN 3077 9 / PGIII
- risk_code
- 20/21/22-50/53
- hazard_code
- Xn,N
- safety_code
- 36/37-60-61
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
개요Calcium-sensing receptor (CaSR) is a G protein-coupled receptor that is involved in calcium homeostasis. Activation of CaSR on parathyroid cells decreases the secretion of parathyroid hormone (PTH), which in turn reduces blood calcium concentration. NPS 2143 is a potent and selective antagonist of CaSR (IC50 = 43 nM) that stimulates PTH secretion from parathyroid cells in vitro (EC50 = 39 nM). It is effective in vivo, causing a sustained increase in plasma PTH in rats when given intravenously. Daily oral administration of NPS 2143 to osteopenic ovariectomized rats results in a dramatic increase in bone turnover, as well as increased circulating PTH levels.
용도NPS 2143 acts as a potent and selective antagonist for CaSR (Calcium-sensing receptor) which is involved in calcium blood concentration homeostasis.
공급사42 곳
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
湖北魏氏化学试剂股份有限公司027-59102966 18717199209 · [email protected]
InvivoChem中国13549236410 · [email protected]
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