2-(6-fluoro-1-oxetan-3-yl-1H-indazol-3-yl)-5-(2-trimethylsilanylethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid isopropylamide (HCID 71279698)

기본 정보

표준 SMILES: CC(C)NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3nn(C4COC4)c4cc(F)ccc34)nc12
InChIKey: NNKBJZHEQPCCEF-UHFFFAOYSA-N
분자식: C26H33FN6O3Si
평균 분자량: 524.7 g/mol

이름 및 식별자

우선 이름: 2-(6-fluoro-1-oxetan-3-yl-1H-indazol-3-yl)-5-(2-trimethylsilanylethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid isopropylamide
IUPAC: 2-[6-fluoro-1-(oxetan-3-yl)indazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide

이름 및 동의어

SCHEMBL14737438NNKBJZHEQPCCEF-UHFFFAOYSA-N2-(6-fluoro-1-oxetan-3-yl-1H-indazol-3-yl)-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid isopropylamide2-(6-fluoro-1-oxetan-3-yl-1H-indazol-3-yl)-5-(2-trimethylsilanylethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid isopropylamide

데이터베이스 식별자

PubChem CID: 71279698

물성

구조 계산 물성

극성 표면적: 96.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 7
회전 가능 결합 수: 9
무거운 원자 수: 37
형식 전하: 0
복잡도: 799

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