((1R)-2-(1,1'-Biphenyl-4-yl)-1-(methyl-((1R)-1-(methylcarbamoyl)-2-phenylethyl)carbamoyl)ethyl)methyl-carbamic acid tert-butylester

HCID 10530245

기본 정보

CAS
193085-62-0
표준 SMILES
CNC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@@H](Cc1ccc(-c2ccccc2)cc1)N(C)C(=O)OC(C)(C)C
InChIKey
BXZARTWTGAEBFT-VSGBNLITSA-N
분자식
C32H39N3O4
평균 분자량
529.7 g/mol
단동위원소 질량
529.29405673

이름 및 식별자

우선 이름
((1R)-2-(1,1'-Biphenyl-4-yl)-1-(methyl-((1R)-1-(methylcarbamoyl)-2-phenylethyl)carbamoyl)ethyl)methyl-carbamic acid tert-butylester
IUPAC
tert-butyl N-methyl-N-[(2R)-1-[methyl-[(2R)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-(4-phenylphenyl)propan-2-yl]carbamate

이름 및 동의어

SCHEMBL6317068BXZARTWTGAEBFT-VSGBNLITSA-NDTXSID101108939((1R)-2-(1,1'-Biphenyl-4-yl)-1-(methyl-((1R)-1-(methylcarbamoyl)-2-phenylethyl)carbamoyl)ethyl)methyl-carbamic acid tert-butylester193085-62-0((1R)-2-(1 ,1'-biphenyl-4-yl)-1-(methyl-((1R)-1-methylcarbamoyl-2-phenylethyl)carbamoyl)ethyl)methylcarbamic acid tert-butyl ester((1R)-2-(1,1 '-Biphenyl-4-yl)-1-(methyl-((1R)-1-(methylcarbamoyl)-2-phenylethyl)-carbamoyl)ethyl)methyl-carbamic acid tert-butylester((1R)-2-(1,1'-Biphenyl-4-yl)-1-(methyl-((1R)-1-(methylcarbamoyl)-2-phenylethyl)-carbamoyl)ethyl)methyl-carbamic acid tert-butylester((1R)-2-(1,1'-biphenyl-4-yl)-1-(methyl-((1R)-1-methylcarbamoyl-2-phenylethyl)carbamoyl)ethyl)methylcarbamic acid tert-butyl esterD-Phenylalaninamide, 3-[1,1a(2)-biphenyl]-4-yl-N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-D-alanyl-N,NI+/--dimethyl-

데이터베이스 식별자

CAS
193085-62-0
PubChem CID
10530245
DTXSID
DTXSID101108939

물성

구조 계산 물성

XLogP
5.6
극성 표면적
79 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
11
무거운 원자 수
39

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6건

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