3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4-dioxo-1,5-bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

HCID 86584977

기본 정보

표준 SMILES
CC(C)CN1C(=O)C(N)(C(=O)[C@H](C)NC(=O)CC2CC2)C(=O)N(CC(C)C)c2ccccc21
InChIKey
LZGZLSXIFIHJTB-KRWDZBQOSA-N
분자식
C25H36N4O4
평균 분자량
456.6 g/mol

이름 및 식별자

우선 이름
3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4-dioxo-1,5-bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
IUPAC
N-[(2S)-1-[3-amino-1,5-bis(2-methylpropyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]-1-oxopropan-2-yl]-2-cyclopropylacetamide

이름 및 동의어

LZGZLSXIFIHJTB-KRWDZBQOSA-N3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4-dioxo-1,5-bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4-dioxo-1,5bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4dioxo- 1,5-bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4dioxo-1,5-bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

데이터베이스 식별자

PubChem CID
86584977

물성

구조 계산 물성

XLogP
3.5
극성 표면적
113 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
5
회전 가능 결합 수
9
무거운 원자 수
33

관련 반응

11건

연결된 노트

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3-[N'-(Cyclopropylacetyl)-L-alaninyl]-amino-2,4-dioxo-1,5-bis-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine (HCID 86584977)|Huagongshe