8-(2-Chloro-6-fluoro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide

HCID 59292964

기본 정보

표준 SMILES
COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCN(C)CC4)cn3)c3nccnc23)c1F
InChIKey
UCGPWBGSZPBDQD-UHFFFAOYSA-N
분자식
C28H28ClFN6O3
평균 분자량
551 g/mol

이름 및 식별자

우선 이름
8-(2-Chloro-6-fluoro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide
IUPAC
8-(2-chloro-6-fluoro-3,5-dimethoxyphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]quinoxaline-5-carboxamide

이름 및 동의어

1197331-38-68-(2-Chloro-6-fluoro-3,5-dimethoxyphenyl)-N-(5-((4-methylpiperazin-1-yl)methyl)pyridin-2-yl)quinoxaline-5-carboxamideSCHEMBL1126528CHEMBL3653123UCGPWBGSZPBDQD-UHFFFAOYSA-NBDBM102540PD129689US8536175, 1448-(2-Chloro-6-fluoro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide

데이터베이스 식별자

PubChem CID
59292964
ChEMBL
CHEMBL3653123

물성

구조 계산 물성

XLogP
3.3
극성 표면적
92.7 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
9
회전 가능 결합 수
7
무거운 원자 수
39

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5건

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