2-(6-fluoro-1-methyl-1H-indazol-3-yl)-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (cis-3-cyanomethyl-cyclopentyl)-amide

HCID 71285589
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기본 정보

표준 SMILES
Cn1nc(-c2cnc3c(n2)c(C(=O)N[C@H]2CC[C@@H](CC#N)C2)cn3COCC[Si](C)(C)C)c2ccc(F)cc21
InChIKey
KKXTUKUIYKQXJS-ICSRJNTNSA-N
분자식
C28H34FN7O2Si
평균 분자량
547.7 g/mol
단동위원소 질량
547.25272805

이름 및 식별자

우선 이름
2-(6-fluoro-1-methyl-1H-indazol-3-yl)-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (cis-3-cyanomethyl-cyclopentyl)-amide
IUPAC
N-[(1S,3R)-3-(cyanomethyl)cyclopentyl]-2-(6-fluoro-1-methylindazol-3-yl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide

이름 및 동의어

SCHEMBL14746307KKXTUKUIYKQXJS-ICSRJNTNSA-N2-(6-fluoro-1-methyl-1H-indazol-3-yl)-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (cis-3-cyanomethyl-cyclopentyl)-amide2-(6-fluoro-1-methyl-1H-indazol-3-yl)-5-(2-trimethylsilanylethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid (cis-3-cyanomethyl-cyclopentyl)-amide

데이터베이스 식별자

PubChem CID
71285589

물성

구조 계산 물성

극성 표면적
111 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
9
무거운 원자 수
39

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