기본 정보
- CAS
1018141-95-1- 표준 SMILES
COC(=O)c1cc(C)nc2c1c(C1CC1)nn2CC(=O)O- InChIKey
YYRCOJWETHBGFO-UHFFFAOYSA-N- 분자식
- C14H15N3O4
- 평균 분자량
- 289.29 g/mol
- 단동위원소 질량
- 289.10625597
이름 및 식별자
- 우선 이름
- 2-(3-Cyclopropyl-4-(methoxycarbonyl)-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
- IUPAC
- 2-(3-cyclopropyl-4-methoxycarbonyl-6-methylpyrazolo[3,4-b]pyridin-1-yl)acetic acid
- 영어명
- [3-Cyclopropyl-4-(methoxycarbonyl)-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetic acid
- 분자식
- C14H15N3O4
- 분자량
- 289.29
이름 및 동의어
1018141-95-12-(3-Cyclopropyl-4-(methoxycarbonyl)-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid[3-cyclopropyl-4-(methoxycarbonyl)-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetic acidMFCD097015102-[3-cyclopropyl-4-(methoxycarbonyl)-6-methyl-1h-pyrazolo[3,4-b]pyridin-1-yl]acetic acid[3-CYCLOPROPYL-4-(METHOXYCARBONYL)-6-METHYLPYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETIC ACID2-(3-cyclopropyl-4-methoxycarbonyl-6-methylpyrazolo[3,4-b]pyridin-1-yl)acetic acidTQB14195SBB024933STK351875AKOS005167596ST099350
이름 더 보기
1H-Pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-4-(methoxycarbonyl)-6-methyl-
CS-0241113EN300-2314502-(3-Cyclopropyl-4-(methoxycarbonyl)-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)aceticacid2-(3-cyclopropyl-4-methoxycarbonyl-6-methyl-pyrazolo[3,4-b]pyridin-1-yl)acetic acid2-[3-cyclopropyl-4-(methoxycarbonyl)-6-methylpyrazolo[5,4-b]pyridinyl]acetic a cid
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 94.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 440
물리화학적 성질
- 끓는 점
- 498.3 · 498.3±45.0 °C(Predicted)
- 밀도
- 1.52 · 1.52±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 3.36 · 3.36±0.10(Predicted)
화학 및 산업
공급사1 곳
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
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