Tert-butyl 4-(2-{(cyclohexylcarbonyl) [(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]amino}-1-phenylethyl)piperidine-1-carboxylate

HCID 58415912

기본 정보

표준 SMILES
Cn1c(=O)c(CN(CC(c2ccccc2)C2CCN(C(=O)OC(C)(C)C)CC2)C(=O)C2CCCCC2)cc2ccccc21
InChIKey
POWPAAWEMVZJJY-UHFFFAOYSA-N
분자식
C36H47N3O4
평균 분자량
585.8 g/mol

이름 및 식별자

우선 이름
Tert-butyl 4-(2-{(cyclohexylcarbonyl) [(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]amino}-1-phenylethyl)piperidine-1-carboxylate
IUPAC
tert-butyl 4-[2-[cyclohexanecarbonyl-[(1-methyl-2-oxoquinolin-3-yl)methyl]amino]-1-phenylethyl]piperidine-1-carboxylate

이름 및 동의어

SCHEMBL2402994POWPAAWEMVZJJY-UHFFFAOYSA-Ntert-butyl 4-(2-{(cyclohexylcarbonyl) [(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]amino}-1-phenylethyl)piperidine-1-carboxylatetert-butyl 4-(2-{(cyclohexylcarbonyl)[(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]amino}-1-phenylethyl)piperidine-1-carboxylate

데이터베이스 식별자

PubChem CID
58415912

물성

구조 계산 물성

XLogP
6.3
극성 표면적
70.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
9
무거운 원자 수
43

관련 반응

4건

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