기본 정보
- CAS
155144-64-2- 표준 SMILES
Cc1cc(-c2cc3c(cc2F)n2c(=O)n(O)c(=O)cc2n3C2CC2)cc(C)n1- InChIKey
SSMFYBHQLFTJSA-UHFFFAOYSA-N- 분자식
- C20H17FN4O3
- 평균 분자량
- 380.4 g/mol
- 단동위원소 질량
- 380.12846858
개요
inhibits DNA relaxation catalyzed by topoisomerase II and enhances DNA cleavage by the same enzyme; structure in first source
이름 및 식별자
- 우선 이름
- Ro 47-3359
- IUPAC
- 5-cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-8-fluoro-2-hydroxypyrimido[1,6-a]benzimidazole-1,3-dione
- 영어명
- Ro 47-3359
- 분자식
- C20H17FN4O3
- 분자량
- 380.377
이름 및 동의어
Ro 47-3359155144-64-2Ro-47-3359DTXSID60165821RefChem:179685DTXCID70883125-Cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-8-fluoro-2-hydroxypyrimido(1,6-a)benzimidazole-1,3(2H,5H)-dione5-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-fluoro-2-hydroxypyrimido[1,6-a]benzimidazole-1,3-dionePyrimido(1,6-a)benzimidazole-1,3(2H,5H)-dione, 5-cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-8-fluoro-2-hydroxy-CCRIS 8211Pyrimido[1,6-a]benzimidazole-1,3(2H,5H)-dione, 5-cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-8-fluoro-2-hydroxy-5-Cyclopropyl-7-(2,6-dimethyl-4-pyridiyl)-8-fluoro-2-hydroxypyrimido(1,6-a)benzimidazole-1,3(2H,5H)-dione
이름 더 보기
orb1699477AKOS027326746Pyrimido(1,6-a)benzimidazole-1,3(2H,5H)-dione, 5-cyclopropyl-7-(2,6-dimethyl-4-pyridiyl)-8-fluoro-2-hydroxy-CS-0077089T285905-Cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-fluoro-2-hydroxypyrimido[1,6-a][1,3]benzimidazole-1,3(2H,5H)-dione
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 77 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 716
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Compounds that inhibit the activity of DNA TOPOISOMERASE II. Included in this category are a variety of ANTINEOPLASTIC AGENTS which target the eukaryotic form of topoisomerase II and ANTIBACTERIAL AGENTS which target the prokaryotic form of topoisomerase II.
공급사3 곳
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
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