Tert-butyl 2-(2-((1-(3-methoxybenzyl)-piperidine-4-yl)(methyl)amino)-2-oxoethoxy)-4,6-dimethylpyrimidine-5-ylcarbamate

HCID 59336172

기본 정보

표준 SMILES
COc1cccc(CN2CCC(N(C)C(=O)COc3nc(C)c(NC(=O)OC(C)(C)C)c(C)n3)CC2)c1
InChIKey
UQBSIWIKUXIKRC-UHFFFAOYSA-N
분자식
C27H39N5O5
평균 분자량
513.6 g/mol

이름 및 식별자

우선 이름
Tert-butyl 2-(2-((1-(3-methoxybenzyl)-piperidine-4-yl)(methyl)amino)-2-oxoethoxy)-4,6-dimethylpyrimidine-5-ylcarbamate
IUPAC
tert-butyl N-[2-[2-[[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-methylamino]-2-oxoethoxy]-4,6-dimethylpyrimidin-5-yl]carbamate

이름 및 동의어

SCHEMBL2850091UQBSIWIKUXIKRC-UHFFFAOYSA-Ntert-butyl 2-(2-((1-(3-methoxybenzyl)-piperidine-4-yl)(methyl)amino)-2-oxoethoxy)-4,6-dimethylpyrimidine-5-ylcarbamatetert-butyl 2-(2-((1-(3-methoxybenzyl)-piperidine-4-yl)(methyl)amino)-2-oxoethoxy)-4,6-dimethylpyrimidine-ylcarbamatetert-butyl 2-(2-((1-(3-methoxybenzyl)piperidine-4-yl)(methyl)amino)-2-oxoethoxy)-4,6-dimethylpyrimidine-5-ylcarbamate

데이터베이스 식별자

PubChem CID
59336172

물성

구조 계산 물성

XLogP
3.5
극성 표면적
106 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
8
회전 가능 결합 수
10
무거운 원자 수
37

관련 반응

5건

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