AG00ILPS

405165-61-9 | Besifloxacin HCl

AG00ILPS

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CAS Number	405165-61-9
Catalog Number	AG00ILPS(AGN-PC-0RNY1A)
Chemical Name	Besifloxacin HCl
IUPAC Name	7-[(3R)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid;hydrochloride
InChI	InChI=1S/C19H21ClFN3O3.ClH/c20-15-16-12(18(25)13(19(26)27)9-24(16)11-4-5-11)7-14(21)17(15)23-6-2-1-3-10(22)8-23;/h7,9-11H,1-6,8,22H2,(H,26,27);1H/t10-;/m1./s1
InChI Key	PMQBICKXAAKXAY-HNCPQSOCSA-N
MDL Number	MFCD14636632
Molecular Formula	C19H22Cl2FN3O3
Molecular Weight	430.3007
SMILES	O=C(C1=CN(C2CC2)C3=C(C=C(F)C(N4C[C@H](N)CCCC4)=C3Cl)C1=O)O.[H]Cl
UNII	7506A6J57T
Synonyms	7-((3R)-aminohexahydro-1H-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, 7-(3-aminohexahydro-1H-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, besifloxacin, besifloxacin hydrochloride, besivance, BOL-303224-A, Besifloxacin hydrochloride, Besifloxacin HCl, 405165-61-9, Besivance, Besifloxacin (Hydrochloride), UNII-7506A6J57T, BOL-303224-A, Besifloxacin HCl (Besivance), Besifloxacin hydrochloride [USAN], 7506A6J57T, Besifloxacin hydrochloride (USAN), 7-[(3R)-3-Aminohexahydro-1H-azepin-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Hydrochloride, BOL 303224a, besifloxacin-hci, Besivance (TN), Besivance hydrochloride, C19H22Cl2FN3O3, SCHEMBL291598, CHEMBL1201761, AOB5079, DTXSID20193529, SS734, EX-A1339, BG0675, s3055, SS-734, AKOS025401618, AN-1100, API0007512, CCG-221259, CS-0713, QC-1565, RL03558, AC-23367, HY-17028, SC-24925, AB0095123, FT-0663073, X3492, D08872, W-5589, 165B619, J-519840, (+)-7-((3R)-3-Aminohexahydro-1H-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid hydrochloride, (R)-7-(3-aminoazepan-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid hydrochloride, (R)-7-(3-Aminohexahydro-1H-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid hydrochloride, 3-Quinolinecarboxylic acid, 7-((3R)-3-aminohexahydro-1H-azepin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, monohydrochloride, 7-[(3R)-3-aminoazepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid hydrochloride, ACN-038171, CID10224595, CID 10224595, B1895, A11330, (R)-7-(3-aminoazepan-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid,

Complexity	656
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	429.102g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	430.301g/mol
Monoisotopic Mass	429.102g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	86.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number