5,5-Dimethyl-10-[4-(2-methylpiperidino)butyryloxy]-8-(4-fluorophenyl-1-methylbutyl)-2-(2-propynyl)-1,2,3,4-tetrahydro-5H[1]benzopyrano[3,4-d] pyridine hydrochloride (HCID 88808582)

기본 정보

표준 SMILES: C#CCN1CCC2=C(C1)c1c(OC(=O)CCCN3CCCCC3C)cc(C(C)(CCC)c3ccc(F)cc3)cc1OC2(C)C.Cl
InChIKey: YGQMRGQCISRNGX-UHFFFAOYSA-N
분자식: C38H50ClFN2O3
평균 분자량: 637.3 g/mol

이름 및 식별자

우선 이름: 5,5-Dimethyl-10-[4-(2-methylpiperidino)butyryloxy]-8-(4-fluorophenyl-1-methylbutyl)-2-(2-propynyl)-1,2,3,4-tetrahydro-5H[1]benzopyrano[3,4-d] pyridine hydrochloride
IUPAC: [8-[2-(4-fluorophenyl)pentan-2-yl]-5,5-dimethyl-2-prop-2-ynyl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl] 4-(2-methylpiperidin-1-yl)butanoate;hydrochloride

이름 및 동의어

SCHEMBL11628935YGQMRGQCISRNGX-UHFFFAOYSA-N5,5-Dimethyl-10-[4-(2-methylpiperidino)butyryloxy]-8-(4-fluorophenyl-1-methylbutyl)-2-(2-propynyl)-1,2,3,4-tetrahydro-5H[1]benzopyrano[3,4-d] pyridine hydrochloride5,5-Dimethyl-10-[4-(2-methylpiperidino)butyryloxy]-8-(4-fluorophenyl-1-methylbutyl)-2-(2-propynyl)-1,2,3,4-tetrahydro-5H[1]benzopyrano[3,4-d]pyridine hydrochloride

데이터베이스 식별자

PubChem CID: 88808582

물성

구조 계산 물성

극성 표면적: 42 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 11
무거운 원자 수: 45
형식 전하: 0
복잡도: 1,070

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