기본 정보
- CAS
137888-49-4- 표준 SMILES
Cn1cc(C(F)(F)F)nc1-c1ccc(OCC(O)CNCCOc2ccc(O)c(C(N)=O)c2)cc1- InChIKey
GKJZEKSHCJELPL-UHFFFAOYSA-N- 분자식
- C23H25F3N4O5
- 평균 분자량
- 494.5 g/mol
개요
2-hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)-2-imidazolyl]phenoxy]propyl]amino]ethoxy]benzamide is a member of imidazoles.
이름 및 식별자
- 우선 이름
- Cgp-20712
- IUPAC
- 2-hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide
- 영어명
- 2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide
- 분자식
- C23H25F3N4O5
- 분자량
- 494.46
이름 및 동의어
CGP-20712137888-49-4Cgp 20712SIO2UEZ19HRefChem:918314CGP-20712ACGP20712ACGP 20712-AUNII-SIO2UEZ19H81015-67-0SR-010000762081-[2-(3-carbamoyl-4-hydroxyphenoxy)-ethylamino]-3-[4-(1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl)-phenoxy]-2-propanol
이름 더 보기
2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamideBenzamide, 2-hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy]propyl]amino]ethoxy]-
1-[2-(3-carbamoyl-4-hydroxyphenoxy)-ethylamino]-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]-phenoxy]-2-propanolcid_2685Lopac0_000364GTPL541CHEMBL280822orb1697871SCHEMBL10914264SCHEMBL29709203
데이터베이스 식별자
- CAS
137888-49-4、81015-67-0- PubChem CID
- 2685
- DTXSID
DTXSID301001709
물성
구조 계산 물성
- XLogP
- 2.3
- 극성 표면적
- 132 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 666
물리화학적 성질
- 끓는 점
- 736 · 736.0±70.0 °C(Predicted)
- 밀도
- 1.4 · 1.40
- 산도 계수 (pKa)
- 8.72 · 8.72±0.20(Predicted)
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Drugs that bind to but do not activate beta-adrenergic receptors thereby blocking the actions of beta-adrenergic agonists. Adrenergic beta-antagonists are used for treatment of hypertension, cardiac arrhythmias, angina pectoris, glaucoma, migraine headaches, and anxiety.
공급사9 곳
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
重庆卡兰医药有限公司[email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
上海博拓生物科技有限公司16621358918 · [email protected]
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