6,7-Dimethoxy-4-(3,4-dimethoxyphenyl)-2-(2-ethylimidazol-1-ylmethyl)quinoline-3-carboxylic acid ethyl ester

HCID 10815422

기본 정보

표준 SMILES
CCOC(=O)c1c(Cn2ccnc2CC)nc2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1
InChIKey
KDWSMGQGSSAICO-UHFFFAOYSA-N
분자식
C28H31N3O6
평균 분자량
505.6 g/mol

이름 및 식별자

우선 이름
6,7-Dimethoxy-4-(3,4-dimethoxyphenyl)-2-(2-ethylimidazol-1-ylmethyl)quinoline-3-carboxylic acid ethyl ester
IUPAC
ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-ethylimidazol-1-yl)methyl]-6,7-dimethoxyquinoline-3-carboxylate

이름 및 동의어

CHEMBL148486SCHEMBL7818134KDWSMGQGSSAICO-UHFFFAOYSA-N6,7-dimethoxy-4-(3,4-dimethoxyphenyl)-2-(2-ethylimidazol-1-ylmethyl)quinoline-3-carboxylic acid ethyl esterethyl 2-(2-ethylimidazol-1-ylmethyl)-6,7-dimethoxy-4-(3,4-dimethoxyphenyl)quinoline-3-carboxylate

데이터베이스 식별자

PubChem CID
10815422
ChEMBL
CHEMBL148486
Nikkaji
J1.076.025I

물성

구조 계산 물성

XLogP
4.5
극성 표면적
93.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
8
회전 가능 결합 수
11
무거운 원자 수
37

관련 반응

6건

화합물 노트

불러오는 중…