4-{[(3-{8-[2-(6,6-Dimethyl-bicyclo(3.1.1]hept-2-yl)-ethyl]-4-oxo-1-phenyl-1,3,8-triaza-spiro[4.5]dec-3-yl} propyl)-methyl-amino]-methyl}-4-hydroxy-piperidine-1-carboxylic Acid Tert-Butyl Ester

HCID 58906460
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기본 정보

표준 SMILES
CN(CCCN1CN(c2ccccc2)C2(CCN(CCC3CCC4CC3C4(C)C)CC2)C1=O)CC1(O)CCN(C(=O)OC(C)(C)C)CC1
InChIKey
FAHGYLLSYBNMFM-UHFFFAOYSA-N
분자식
C39H63N5O4
평균 분자량
665.9 g/mol

이름 및 식별자

우선 이름
4-{[(3-{8-[2-(6,6-Dimethyl-bicyclo(3.1.1]hept-2-yl)-ethyl]-4-oxo-1-phenyl-1,3,8-triaza-spiro[4.5]dec-3-yl} propyl)-methyl-amino]-methyl}-4-hydroxy-piperidine-1-carboxylic Acid Tert-Butyl Ester
IUPAC
tert-butyl 4-[[3-[8-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]propyl-methylamino]methyl]-4-hydroxypiperidine-1-carboxylate

이름 및 동의어

SCHEMBL14452961FAHGYLLSYBNMFM-UHFFFAOYSA-N4-{[(3-{8-[2-(6,6-Dimethyl-bicyclo(3.1.1]hept-2-yl)-ethyl]-4-oxo-1-phenyl-1,3,8-triaza-spiro[4.5]dec-3-yl} propyl)-methyl-amino]-methyl}-4-hydroxy-piperidine-1-carboxylic Acid Tert-Butyl Ester

데이터베이스 식별자

PubChem CID
58906460

물성

구조 계산 물성

XLogP
6.3
극성 표면적
79.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
12
무거운 원자 수
48

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