1-(2-((6,7-Dimethoxyquinolin-4-yl)oxy)-4,5-dimethylphenyl)ethan-1-one

HCID 10066538

기본 정보

표준 SMILES
COc1cc2nccc(Oc3cc(C)c(C)cc3C(C)=O)c2cc1OC
InChIKey
AAUXGXRHLYYHSO-UHFFFAOYSA-N
분자식
C21H21NO4
평균 분자량
351.4 g/mol
단동위원소 질량
351.14705815

이름 및 식별자

우선 이름
1-(2-((6,7-Dimethoxyquinolin-4-yl)oxy)-4,5-dimethylphenyl)ethan-1-one
IUPAC
1-[2-(6,7-dimethoxyquinolin-4-yl)oxy-4,5-dimethylphenyl]ethanone

이름 및 동의어

666729-57-31-(2-((6,7-Dimethoxyquinolin-4-yl)oxy)-4,5-dimethylphenyl)ethan-1-oneCHEMBL500149TGF-|A RI Kinase Inhibitor VII1-{2-[(6,7-dimethoxy-4-quinolyl)oxy]-4,5-dimethylphenyl}-1-ethanoneTGF-BETA RI KINASE INHIBITOR VIITGF-|ARI inhibitor 3orb2944882SCHEMBL3895969AAUXGXRHLYYHSO-UHFFFAOYSA-NBDBM50272008DB-180658
이름 더 보기
HY-137918G65841T2052151-[2-(6,7-Dimethoxy-quinolin-4-yloxy)-4,5-dimethylphenyl]-1-ethanone1-[2-[(6,7-Dimethoxy-4-quinolinyl)oxy]-4,5-dimethylphenyl]ethanone1-[2-[(6,7-dimethoxy-4-quinolyl)oxy]-4,5-dimethyl-phenyl]ethanone

데이터베이스 식별자

PubChem CID
10066538
ChEMBL
CHEMBL500149

물성

구조 계산 물성

XLogP
4.1
극성 표면적
57.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
5
무거운 원자 수
26

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