기본 정보
- CAS
119193-37-2- 표준 SMILES
CN1C2CCC1CC(NC(=O)c1nn(C)c3ccccc13)C2- InChIKey
DDHAJFBBJWHSBR-UHFFFAOYSA-N- 분자식
- C17H22N4O
- 평균 분자량
- 298.4 g/mol
- 단동위원소 질량
- 298.17936134
개요
1-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-3-indazolecarboxamide is a member of indazoles and an aromatic amide.
이름 및 식별자
- 우선 이름
- 1-Methyl-N-(8-methyl-8-azabicyclo(3.2.1)oct-3-yl)-1H-indazole-3-carboxamide
- IUPAC
- 1-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)indazole-3-carboxamide
- 영어명
- LY 278584
- 분자식
- C17H22N4O
- 분자량
- 298.38
이름 및 동의어
LY 278584119193-37-2LY-278,584 maleate1-Methyl-N-(8-methyl-8-azabicyclo(3.2.1)oct-3-yl)-1H-indazole-3-carboxamide109216-58-21-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)indazole-3-carboxamide1-Methyl-N-[(3-endo)-8-methyl-8-azabicyclo[3.2.1]-oct-3-yl]-1H-indazole-3-carboxamideLY2785841-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-3-indazolecarboxamideBiomol-NT_000163Lopac0_000741BPBio1_000507
이름 더 보기
CID 5311254LY-2785841H-Indazole-3-carboxamide, 1-methyl-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-yl)-1-METHYL-N-[(1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL]INDAZOLE-3-CARBOXAMIDE
CHEMBL291046SCHEMBL9485783BDBM84739CHEBI:91535DTXSID10922885NSC_3970UEA19337AKOS040748814
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 50.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 428
물리화학적 성질
- 끓는 점
- 522.1 · 522.1±40.0 °C(Predicted)
- 밀도
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- 물리적 상태
- Solid
- 산도 계수 (pKa)
- 12.34 · 12.34±0.20(Predicted)
화학 및 산업
공급사5 곳
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
杭州宇昊化工科技有限公司0571-82693216 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
济南药研药物化学有限公司[email protected]
南京美韬医药科技有限公司[email protected] · [email protected]
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