N-[1-[[(2'-Acetoxy)[1,1'-biphenyl]-4-yl]methyl]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-3(R)-yl]-3-t-butoxycarbonylamino-3-methylbutanamide

HCID 22877467

기본 정보

표준 SMILES
CC(=O)Oc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)CC(C)(C)NC(=O)OC(C)(C)C)CCc3ccccc32)cc1
InChIKey
YFTVBIINURKXCM-MUUNZHRXSA-N
분자식
C35H41N3O6
평균 분자량
599.7 g/mol

이름 및 식별자

우선 이름
N-[1-[[(2'-Acetoxy)[1,1'-biphenyl]-4-yl]methyl]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-3(R)-yl]-3-t-butoxycarbonylamino-3-methylbutanamide
IUPAC
[2-[4-[[(3R)-3-[[3-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]phenyl] acetate

이름 및 동의어

SCHEMBL7785915YFTVBIINURKXCM-MUUNZHRXSA-N3-[[1-[[2'-acetoxy-[1,1'-biphenyl]-4-yl]methyl]-2,3,4,5-tetrahydro-2-oxo-1H-benzazepin -3(R)-yl]amino]-1,1-dimethyl-3-oxopropylcarbamic acid, 1,1-dimethyethyl ester3-[[1-[[2'-acetoxy-[1,1'-biphenyl]-4-yl]methyl]-2,3,4,5-tetrahydro-2-oxo-1H-benzazepin-3(R)-yl]amino]-1,1-dimethyl-3-oxopropylcarbamic acid, 1,1-dimethylethyl esterN-[1-[[(2'-Acetoxy)[1,1'-biphenyl]-4-yl]methyl]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-3(R)-yl]-3-t-butoxycarbonylamino-3-methylbutanamide

데이터베이스 식별자

PubChem CID
22877467

물성

구조 계산 물성

XLogP
5.2
극성 표면적
114 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
11
무거운 원자 수
44

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5건

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