2-[1-(3,4-Dimethoxy-benzyl)6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(6-methoxy-indan-1-yl)-acetamide (HCID 10864538)

기본 정보

표준 SMILES: COc1ccc2c(c1)C(NC(=O)CN1CCc3cc(OC)c(OC)cc3C1Cc1ccc(OC)c(OC)c1)CC2
InChIKey: JWMZPZFSAXVGMK-UHFFFAOYSA-N
분자식: C32H38N2O6
평균 분자량: 546.7 g/mol

이름 및 식별자

우선 이름: 2-[1-(3,4-Dimethoxy-benzyl)6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(6-methoxy-indan-1-yl)-acetamide
IUPAC: 2-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)acetamide

이름 및 동의어

CHEMBL493427SCHEMBL4427404JWMZPZFSAXVGMK-UHFFFAOYSA-NBDBM50292952(+/-)-2-(1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)acetamide2-[1-(3,4-Dimethoxy-benzyl)6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(6-methoxy-indan-1-yl)-acetamide

데이터베이스 식별자

PubChem CID: 10864538
ChEMBL: CHEMBL493427

물성

구조 계산 물성

XLogP: 4.9
극성 표면적: 78.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 7
회전 가능 결합 수: 10
무거운 원자 수: 40
형식 전하: 0
복잡도: 814

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