1'-[2-(5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetyl]-1',2',3',4',5',6'-hexahydro-[2,4']bipyridinyl-6-carboxylic acid methyl-(1,2,3,4-tetrahydro-naphthalen-1-yl)-amide

HCID 66686376
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기본 정보

표준 SMILES
Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2cccc(C(=O)N(C)C3CCCc4ccccc43)n2)CC1
InChIKey
JSSIVEYYVTZWPG-UHFFFAOYSA-N
분자식
C29H32F3N5O2
평균 분자량
539.6 g/mol

이름 및 식별자

우선 이름
1'-[2-(5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetyl]-1',2',3',4',5',6'-hexahydro-[2,4']bipyridinyl-6-carboxylic acid methyl-(1,2,3,4-tetrahydro-naphthalen-1-yl)-amide
IUPAC
N-methyl-6-[1-[2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]piperidin-4-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-2-carboxamide

이름 및 동의어

1'-[2-(5-methyl-3-trifluoromethyl-pyrazol-1-yl)-acetyl]-1',2',3',4',5',6'-hexahydro-[2,4']bipyridinyl-6-carboxylic acid methyl-(1,2,3,4-tetrahydro-naphthalen-1-yl)-amideSCHEMBL4383911'-[2-(5-methyl-3-trifluoromethyl-pyrazol-1-yl)-acetyl]-1',2',3',4',5',6'-hexahydro-[2,4]bipyridinyl-6-carboxylic acid methyl-(1,2,3,4-tetrahydro-naphthalen-1-yl)-amide

데이터베이스 식별자

PubChem CID
66686376

물성

구조 계산 물성

XLogP
4.5
극성 표면적
71.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
5
무거운 원자 수
39

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