기본 정보
- CAS
1004727-50-7- 표준 SMILES
CCCn1nc(C)c2c(C(=O)O)cc(-c3cnn(C)c3C)nc21- InChIKey
RQXZDEBJQCILKY-UHFFFAOYSA-N- 분자식
- C16H19N5O2
- 평균 분자량
- 313.35 g/mol
- 단동위원소 질량
- 313.15387487
이름 및 식별자
- 우선 이름
- 6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
- IUPAC
- 6-(1,5-dimethylpyrazol-4-yl)-3-methyl-1-propylpyrazolo[5,4-b]pyridine-4-carboxylic acid
- 영어명
- 6-(1,5-DIMETHYL-1 H-PYRAZOL-4-YL)-3-METHYL-1-PROPYL-1 H-PYRAZOLO[3,4-B ]PYRIDINE-4-CARBOXYLIC ACID
- 분자식
- C16H19N5O2
- 분자량
- 313.35
이름 및 동의어
1004727-50-76-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acidMFCD067393256-(1,5-dimethylpyrazol-4-yl)-3-methyl-1-propylpyrazolo[3,4-b]pyridine-4-carboxylic acidEQB72750SBB023275STK350437AKOS0003126516-(1,5-DIMETHYL-1H-PYRAZOL-4-YL)-3-METHYL-1-PROPYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLICACIDCS-0240873EN300-230371Z2106594922
이름 더 보기
AKOS B028524ART-CHEM-BB B0285241H-Pyrazolo[3,4-b]pyridine-4-carboxylic acid, 6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-6-(1,5-DIMETHYL-1 H-PYRAZOL-4-YL)-3-METHYL-1-PROPYL-1 H-PYRAZOLO[3,4-B ]PYRIDINE-4-CARBOXYLIC ACID
6-(1,5-dimethylpyrazol-4-yl)-3-methyl-1-propyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid6-(1,5-dimethylpyrazol-4-yl)-3-methyl-1-propylpyrazolo[5,4-b]pyridine-4-carbox ylic acid6-(1,5-dimethyl-1 h-pyrazol-4-yl)-3-methyl-1-propyl-1 h-pyrazolo[3,4-b]pyridine-4-carboxylic acid
데이터베이스 식별자
- CAS
1004727-50-7- PubChem CID
- 7174577
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 85.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 448
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