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기본 정보
- CAS
195532-12-8- 표준 SMILES
N#Cc1c(N2C[C@@H]3CCCN[C@@H]3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12- InChIKey
LZLXHGFNOWILIY-APPDUMDISA-N- 분자식
- C21H21FN4O3
- 평균 분자량
- 396.4 g/mol
- 단동위원소 질량
- 396.15976871
이름 및 식별자
- 우선 이름
- Pradofloxacin
- IUPAC
- 7-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-8-cyano-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
- 영어명
- Pradofloxacin
- 분자식
- C21H21FN4O3
- 분자량
- 396.41
이름 및 동의어
Pradofloxacin195532-12-8Verafloxpradofloxacinepradofloxacino6O0T5E048IDTXSID60173229pradofloxacinumRefChem:58490DTXCID80957207-((4aS,7aS)-octahydro-1H-pyrrolo(3,4-b)pyridin-6-yl)-8-cyano-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid8-cyano-1-cyclopropyl-6-fluoro-7-((4aS,7aS)-octahydro-6H-pyrrolo(3,4-b)pyridin-6-yl)-4-oxo-1,4-dihydoquinoline-3-carboxylic acid
이름 더 보기
8-Cyano-1-cyclopropyl-6-fluoro-1,4-dihydro-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylic acidPradofloxacin (Veraflox)8-cyano-1-cyclopropyl-7-((1S,6S)-2,8-diazabicyclo[4.3.0]nonan-8-yl)-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid3-Quinolinecarboxylic acid, 8-cyano-1-cyclopropyl-6-fluoro-1,4-dihydro-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-
Pradofloxacin [INN]8-Cyano-1-cyclopropyl-6-fluoro-7-((4aS,7aS)-hexahydro-1H-pyrrolo[3,4-b]pyridin-6(2H)-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid7-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-8-cyano-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acidPudofloxacinUNII-6O0T5E048I8-Cyano-1-cyclopropyl-6-fluoro-7-((4aS,7aS)-octahydro-6H-pyrrolo(3,4-b)pyridin-6-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid8-cyano-1-cyclopropyl-6-fluoro-7-((4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid8-Cyano-1-cyclopropyl-6-fluoro-7-[(4aS,7aS)-hexahydro-1H-pyrrolo[3,4-b]pyridin-6(2H)-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylic Acid
물성
구조 계산 물성보충 중
- XLogP
- 0.4
- 극성 표면적
- 96.7 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 803
물리화학적 성질
- 녹는점
- 246 · 246-248°C
- 끓는 점
- 664.5 · 664.5±55.0 °C(Predicted)
- 밀도
- 1.5 · 1.50±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 6.38 · 6.38±0.50(Predicted)
- 물리적 상태
- Solid
- 색상
- Light yellow to yellow
- InChIKey
- LZLXHGFNOWILIY-APPDUMDISA-N
- SMILES
- N1(C2CC2)C2=C(C=C(F)C(N3C[C@]4([H])CCCN[C@]4([H])C3)=C2C#N)C(=O)C(C(O)=O)=C1
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
P203, P264, P270, P280, P301+P317, P318, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 24 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Muta. 2 (100%)
안전 데이터
- 신호 어
- Warning
- 유해·위험 문구
- 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302
화학 및 산업
약리 정보
ATC CodeQJ - Antiinfectives for systemic use；QJ01 - Antibacterials for systemic use；QJ01M - Quinolone and quinoxaline antibacterials；QJ01MA - Fluoroquinolones；QJ01MA97 - Pradofloxacin
용도 및 제조
Use ClassificationAnimal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients
응용 분야
용도Pradofloxacin is a novel fluoroquinolone antibiotic. An antimicrobial agent.
공급사55 곳
上海沛灵生物科技有限公司13127581762 13127581762 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
湖北海克斯生化有限公司17362916295; 17362916295 · [email protected]
湖北海克斯生化有限公司18696113233 · [email protected]
Suzhou Biosyntech Co., Ltd[email protected]
湖北威德利化学试剂有限公司17771473825 13385289472 · [email protected]
湖北魏氏化学试剂股份有限公司027-59102966 18717199209 · [email protected]
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