tert-butyl 4-(5-(4-((1,2-dihydro-4,6-dimethyl-2-oxopyridin-3-yl)methylcarbamoyl)-1-isopropyl-3-methyl-1H-indazol-6-yl)pyridin-2-yl)piperazine-1-carboxylate

HCID 67468774

기본 정보

표준 SMILES
Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(N4CCN(C(=O)OC(C)(C)C)CC4)nc3)cc3c2c(C)nn3C(C)C)c(=O)[nH]1
InChIKey
BMLKWELMVPYMBO-UHFFFAOYSA-N
분자식
C34H43N7O4
평균 분자량
613.7 g/mol

이름 및 식별자

우선 이름
tert-butyl 4-(5-(4-((1,2-dihydro-4,6-dimethyl-2-oxopyridin-3-yl)methylcarbamoyl)-1-isopropyl-3-methyl-1H-indazol-6-yl)pyridin-2-yl)piperazine-1-carboxylate
IUPAC
tert-butyl 4-[5-[4-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylcarbamoyl]-3-methyl-1-propan-2-ylindazol-6-yl]-2-pyridinyl]piperazine-1-carboxylate

이름 및 동의어

SCHEMBL2595145BMLKWELMVPYMBO-UHFFFAOYSA-Ntert-butyl 4-(5-(4-((1,2-dihydro-4,6-dimethyl-2-oxopyridin-3-yl)methylcarbamoyl)-1-isopropyl-3-methyl-1H-indazol-6-yl)pyridin-2-yl)piperazine-1-carboxylate

데이터베이스 식별자

PubChem CID
67468774

물성

구조 계산 물성

XLogP
4.3
극성 표면적
122 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
7
회전 가능 결합 수
8
무거운 원자 수
45

관련 반응

4건

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