dequalinium

dequalinium
Clinical data
Trade names	Dequadin, Fluomizin, Vablys, Naxyl, others
Routes of; administration	By mouth, intravaginal
ATC code	D08AH01 (WHO) G01AC05 (WHO), R02AA02 (WHO);
Legal status
Legal status	CA: ℞-only; UK: POM (Prescription only);
Identifiers
	IUPAC name 1,1'-decane-1,10-diylbis(4-amino-2-methylquinolinium) decyl]-2-methyl-4-quinolin-1-iumamine dichloride;
CAS Number	6707-58-0;
PubChem CID	2993;
IUPHAR/BPS	2313;
DrugBank	DB04209;
ChemSpider	2886;
UNII	E7QC7V26B8;
ChEBI	CHEBI:31466;
ChEMBL	ChEMBL333826; ChEMBL121663;
Chemical and physical data
Formula	C30H40N4
Molar mass	456.678 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES c12ccccc1c(cc([n+]2CCCCCCCCCC[n+]4c3ccccc3c(N)cc4C)C)N;
	InChI InChI=1S/C30H38N4/c1-23-21-27(31)25-15-9-11-17-29(25)33(23)19-13-7-5-3-4-6-8-14-20-34-24(2)22-28(32)26-16-10-12-18-30(26)34/h9-12,15-18,21-22,31-32H,3-8,13-14,19-20H2,1-2H3/p+2; Key:PCSWXVJAIHCTMO-UHFFFAOYSA-P;