5-tert-Butyl 1-ethyl 3-[4-(4-methylpiperazin-1-yl)benzamido]-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate
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기본 정보
- CAS
761443-69-0- 표준 SMILES
CCOC(=O)n1nc(NC(=O)c2ccc(N3CCN(C)CC3)cc2)c2c1CN(C(=O)OC(C)(C)C)C2- InChIKey
YLYRHIITRIEACU-UHFFFAOYSA-N- 분자식
- C25H34N6O5
- 평균 분자량
- 498.584 g/mol
- 단동위원소 질량
- 498.25906819
이름 및 식별자
- 우선 이름
- 5-tert-Butyl 1-ethyl 3-[4-(4-methylpiperazin-1-yl)benzamido]-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate
- IUPAC
- 5-tert-Butyl 1-ethyl 3-[4-(4-methylpiperazin-1-yl)benzamido]-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate
- 영어명
- 1-ETHYLOXYCARBONYL-3-[4-(4-METHYL-PIPERAZIN-1-YL)-BENZOYLAMINO]-5-BOC-4,6-DIHYDRO-PYRROLO[3,4-C]PYRAZOLE
- 분자식
- C25H34N6O5
- 분자량
- 498.58
이름 및 동의어
1-Ethyloxycarbonyl-3-[4-(4-Methyl-piperazin-1-yl)-benzoylaMino]-5-Boc-4,6-dihydr3-[4-(4-Methyl-piperazin-1-yl)-benzoylamino]-4,6-dihydro-pyrrolo[3,4-c]pyrazole-1,5-1-ETHYLOXYCARBONYL-3-[4-(4-METHYL-PIPERAZIN-1-YL)-BENZOYLAMINO]-5-BOC-4,6-DIHYDRO-PYRROLO[3,4-C]PYRAZOLE5-tert-butyl 1-ethyl 3-{[4-(4-Methylpiperazin-1-yl)benzoyl]aMino}-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylateEthyl 5-(tert-butoxycarbonyl)-3-[[4-(4-methylpiperazin-1-yl)benzoyl]amino]-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylate5-(tert-Butyl)1-ethyl3-((4-(4-methylpiperazin-1-yl)benzoyl)imino)-2,3,4,6-tetrahydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylatePyrrolo[3,4-c]pyrazole-1,5-dicarboxylic acid, 4,6-dihydro-3-[[4-(4-methyl-1-piperazinyl)benzoyl]amino]-, 5-(1,1-dimethylethyl) 1-ethyl ester
데이터베이스 식별자
- CAS
761443-69-0- PubChem CID
- 11237328
- DTXSID
DTXSID60459676
물성
물리화학적 성질
- 밀도
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.37 · 13.37±0.20(Predicted)
관련 반응
2건
화합물 노트
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