tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-5-((methoxy)(methyl)carbamoyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

HCID 59398223

기본 정보

표준 SMILES
COc1cc(C(=O)N(C)OC)c2ccc(=O)n(CCN3CCC(N(Cc4ccc5c(c4)OCCO5)C(=O)OC(C)(C)C)CC3)c2c1
InChIKey
YDVLEVJHFPLRTA-UHFFFAOYSA-N
분자식
C34H44N4O8
평균 분자량
636.7 g/mol

이름 및 식별자

우선 이름
tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-5-((methoxy)(methyl)carbamoyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate
IUPAC
tert-butyl N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-[1-[2-[7-methoxy-5-[methoxy(methyl)carbamoyl]-2-oxoquinolin-1-yl]ethyl]piperidin-4-yl]carbamate

이름 및 동의어

SCHEMBL2800691YDVLEVJHFPLRTA-UHFFFAOYSA-Ntert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-5-((methoxy)(methyl)carbamoyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamatetert-butyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-5-((methoxy)(methyl)carbamoyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

데이터베이스 식별자

PubChem CID
59398223

물성

구조 계산 물성

XLogP
3.7
극성 표면적
110 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
9
회전 가능 결합 수
11
무거운 원자 수
46

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6건

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