Rufloxacin

HCID 58258CAS 101363-10-4

部分構造検索類似構造を探す

基本情報

標準SMILES: CN1CCN(c2c(F)cc3c(=O)c(C(=O)O)cn4c3c2SCC4)CC1
InChIKey: NJCJBUHJQLFDSW-UHFFFAOYSA-N
分子式: C17H18FN3O3S
平均分子量: 363.4 g/mol
単同位体質量: 363.10529066

概要

Rufloxacin is a member of quinolines, a quinolone antibiotic and a fluoroquinolone antibiotic.

名称と識別子

優先名称: Rufloxacin
IUPAC: 7-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-4-thia-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid

名称と別名

Rufloxacin101363-10-4RufloxacineRufloxacinoRufloxacinumMF 934MonosNSC-7598357-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-4-thia-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acidY521XM2900DTXSID6048412Tebraxin

名称をさらに表示

9-fluoro-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7h-[1,4]thiazino[2,3,4-ij]quinoline-6-carboxylic acidrufloxacinaUroflox7-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-4-thia-1-azatricyclo(7.3.1.0^(5,13))trideca-5(13),6,8,11-tetraene-11-carboxylic acid7-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-4-thia-1-azatricyclo(7.3.1.05,13)trideca-5(13),6,8,11-tetraene-11-carboxylic acid7-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-4-thia-1-azatricyclo[7.3.1.0^{5,13}]trideca-5(13),6,8,11-tetraene-11-carboxylic acid9-fluoro-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-(1,4)thiazino(2,3,4-ij)quinoline-6-carboxylic acidRefChem:180288

データベース識別子

CAS: 101363-10-4
PubChem CID: 58258
DTXSID: DTXSID6048412
ChEMBL: CHEMBL295619
ChEBI: CHEBI:8909
UNII: Y521XM2900
EC Number: 842-241-1
Nikkaji: J365.971B

物性

構造計算による物性

XLogP: -0.3
極性表面積: 89.4 Å²
水素結合供与体数: 1
水素結合受容体数: 8
回転可能結合数: 2
重原子数: 25
形式電荷: 0
複雑度: 608

実験および物理化学的性質

Drugs · 3 件

Pharmaceuticals -> Antibiotics

Pharmaceuticals -> Listed in ZINC15

Pharmaceuticals -> Anti infectives for systemic use -> Antibacterials for systemic use

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)

化学と産業

薬理情報

ATC Code · 2 件

J - Antiinfectives for systemic use

QJ - Antiinfectives for systemic use

Mechanism of ActionRufloxacin is a fluoroquinolone antibacterial that inhibits bacterial DNA gyrase, blocking DNA supercoiling and replication.

MeSH Pharmacological Classification · 1 件

Compounds that inhibit the activity of DNA TOPOISOMERASE II. Included in this category are a variety of ANTINEOPLASTIC AGENTS which target the eukaryotic form of topoisomerase II and ANTIBACTERIAL AGENTS which target the prokaryotic form of topoisomerase II.