tert-butyl (S)-3-methyl-2-{[cis-3-(5-methyl-2-p-tolyloxazol-4-ylmethoxy)cyclohexylmethyl]amino}butyrate

HCID 86597944

기본 정보

표준 SMILES
Cc1ccc(-c2nc(CO[C@@H]3CCC[C@H](CN[C@H](C(=O)OC(C)(C)C)C(C)C)C3)c(C)o2)cc1
InChIKey
RCINKPHVMAXNBC-PWWKTKHKSA-N
분자식
C28H42N2O4
평균 분자량
470.6 g/mol
단동위원소 질량
470.31445783

이름 및 식별자

우선 이름
tert-butyl (S)-3-methyl-2-{[cis-3-(5-methyl-2-p-tolyloxazol-4-ylmethoxy)cyclohexylmethyl]amino}butyrate
IUPAC
tert-butyl (2S)-3-methyl-2-[[(1S,3R)-3-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]cyclohexyl]methylamino]butanoate

이름 및 동의어

RCINKPHVMAXNBC-PWWKTKHKSA-Ntert-butyl (S)-3-methyl-2-{[cis-3-(5-methyl-2-p-tolyloxazol-4-yl-methoxy)cyclohexylmethyl]amino}butyratetert-butyl (S)-3-methyl-2-{[cis-3-(5-methyl-2-p-tolyloxazol-4-ylmethoxy)cyclohexylmethyl]-amino}butyratetert-butyl (S)-3-methyl-2-{[cis-3-(5-methyl-2-p-tolyloxazol-4-ylmethoxy)cyclohexylmethyl]amino}butyrate

데이터베이스 식별자

PubChem CID
86597944

물성

구조 계산 물성

XLogP
5.8
극성 표면적
73.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
11
무거운 원자 수
34

관련 반응

4건

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