기본 정보
- CAS
947179-32-0- 표준 SMILES
Cc1cc(B2OC(C)(C)C(C)(C)O2)cc(C(=O)Nc2ccn(C)n2)n1- InChIKey
PYLYNLBYXADNMZ-UHFFFAOYSA-N- 분자식
- C17H23BN4O3
- 평균 분자량
- 342.2 g/mol
- 단동위원소 질량
- 342.186321
이름 및 식별자
- 우선 이름
- 2-Methyl-6-((1-methyl-1H-pyrazol-3-yl)carbamoyl)pyridine-4-boronic acid pinacol ester
- IUPAC
- 6-methyl-N-(1-methylpyrazol-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide
- 영어명
- 2-Pyridinecarboxamide, 6-methyl-N-(1-methyl-1H-pyrazol-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- 분자식
- C17H23BN4O3
- 분자량
- 342.2
이름 및 동의어
947179-32-02-Methyl-6-((1-methyl-1H-pyrazol-3-yl)carbamoyl)pyridine-4-boronic acid pinacol ester6-methyl-N-(1-methylpyrazol-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide6-Methyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridine-2-carboxylic acid (1-methyl-1H-pyrazol-3-yl)-amideMFCD11617873SCHEMBL1795809C17H23BN4O3PYLYNLBYXADNMZ-UHFFFAOYSA-NDTXSID701109797DB-3071646-Methyl-N-(1-methyl-1H-pyrazol-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinecarboxamide6-methyl-N-(1-methyl-1H-pyrazol-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)picolinamide
이름 더 보기
6-Methyl-N-(1-Methyl-1H-pyrazol-4-yl)-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)picolinaMide2-Pyridinecarboxamide, 6-methyl-N-(1-methyl-1H-pyrazol-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
데이터베이스 식별자
- CAS
947179-32-0- PubChem CID
- 67163979
- DTXSID
DTXSID701109797
물성
구조 계산 물성
- 극성 표면적
- 78.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 500
화학 및 산업
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