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기본 정보
- CAS
1320288-17-2- 표준 SMILES
COc1cc2c(NC3CCN(C4CCCCC4)CC3)nc(N3CCCN(C(C)C)CC3)nc2cc1OCCCN1CCCCC1- InChIKey
OUKWLRHRXOPODD-UHFFFAOYSA-N- 분자식
- C36H59N7O2
- 평균 분자량
- 621.915 g/mol
- 단동위원소 질량
- 621.47302413
이름 및 식별자
- 우선 이름
- N-(1-Cyclohexylpiperidin-4-yl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)-2-(4-propan-2-yl-1,4-diazepan-1-yl)quinazolin-4-amine
- 영어명
- UNC0646
- 분자식
- C36H59N7O2
- 분자량
- 621.9
이름 및 동의어
CS-792UNC0646UNC0646 ，S7020UNC0646/UNC-0646UNC0646, 10 mM in DMSOUNC 0646UNC0646UNC-0646N-(1-cyclohexylpiperidin-4-yl)-2-(4-isopropyl-1,4-diazepan-1-yl)-6-Methoxy-7-(3-(piperidin-1-yl)propoxy)quinazolin-4-aMineN-(1-Cyclohexyl-4-piperidinyl)-2-(4-isopropyl-1,4-diazepan-1-yl)- 6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinamineN-(1-cyclohexylpiperidin-4-yl)-6-methoxy-7-[3-(piperidin-1-yl)propoxy]-2-[4-(propan-2-yl)-1,4-diazepan-1-yl]quinazolin-4-amine(1-CYCLOHEXYL-PIPERIDIN-4-YL)-[2-(4-ISOPROPYL-[1,4]DIAZEPAN-1-YL)-6-METHOXY-7-(3-PIPERIDIN-1-YL-PROPOXY)-QUINAZOLIN-4-YL]-AMINE
데이터베이스 식별자
- CAS
1320288-17-2- PubChem CID
- 53315882
- DTXSID
DTXSID901025975- ChEMBL
CHEMBL1829304- ChEBI
CHEBI:124924- UNII
- Z5F4D95Y7J
- Nikkaji
- J3.735.639E
물성
물리화학적 성질
- 끓는 점
- 754.6 · 754.6±70.0 °C(Predicted)
- 밀도
- 1.128 · 1.128±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · Keep in dark place,Sealed in dry,2-8°C
- 용해도
- 2 mg/mL, · DMSO: 용해성2mg/mL, 투명(가온)
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 9.34 · 9.34±0.70(Predicted)
- 색상
- 흰색에서 베이지색
- InChIKey
- OUKWLRHRXOPODD-UHFFFAOYSA-N
- SMILES
- N2(CCC(CC2)Nc3nc(nc5c3cc(c(c5)OCCCN6CCCCC6)OC)N4CCN(CCC4)C(C)C)C1CCCCC1
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
개요G9a and G9a-like protein (GLP) are euchromatic histone-lysine methyltransferases (EHMT2 and EHMT1, respectively) that can heterodimerize with each other to methylate several proteins in addition to histone H3. UNC0646 is a potent and selective inhibitor of G9a and GLP activities in vitro (IC50s = 6 and 15 nM, respectively) and G9a/GLP-mediated dimethylation of histone 3 on lysine 9 in MDA-MB-231 cells (IC50 = 26 nM). It is highly selective for G9a/GLP over several other protein lysine and arginine methyltransferases. UNC0646 potently inhibits G9a/GLP activity in a variety of cancer cell lines as well as in the human fetal lung IMR-90 line. This compound selectively targets the corepressor function of G9a without affecting its ability to act as a coactivator with glucocorticoid receptor.
용도UNC0646 is a novel Protein lysine methyltransferase G9a inhibitor.
공급사53 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海波以尔化工有限公司[email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
InvivoChem中国13549236410 · [email protected]
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