RefChem:120362

4,21-dithia-14-aza-11-azoniapentacyclo[12.7.0.03,11.05,10.015,20]henicosa-1,3(11),5,7,9,15,17,19-octaene bromide

Also Known As: EINECS 259-366-7|13,14-Dihydrobisbenzothiazolo(3,2-d:2',3'-g)(1,4)diazepin-12-ium bromide|Bisbenzothiazolo(3,2-d:2',3'-g)(1,4)diazepin-12-ium, 13,14-dihydro-, bromide|13,14-dihydro[1,3]benzothiazolo[3',2':4,5][1,4]diazepino[7,1-b][1,3]benzothiazol-12-ium bromide|Bisbenzothiazolo(3,2-d:2',3'-g)(1,4)diazepin-12-ium, 13,14-dihydro-, bromide (1:1)|Bisbenzothiazolo[3,2-d:2',3'-g][1,4]diazepin-12-ium, 13,14-dihydro-, bromide|Bisbenzothiazolo[3,2-d:2',3'-g][1,4]diazepin-12-ium, 13,14-dihydro-, bromide (1:1)|13,14-dihydrobisbenzothiazolo[3,2-d:2',3'-g][1,4]diazepin-12-ium bromide|Bisbenzothiazolo(3,2-d:2',3'-g)(1,4)diazepin-12-ium, 13,14-dihydro-, bromide (1:|Bisbenzothiazolo[3,2-d:2', 3'-g][1,4]diazepin-12-ium, 13,14-dihydro-, bromide

Molecular Formula	C17H13BrN2S2
Molecular Weight	387.97034 g/mol
LogP	1.12
Topological Polar Surface Area	7.12 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	387.97034
Heavy Atoms	22
Complexity	900.6

Chemical Identifiers

CAS Number	54830-47-6
SMILES	C1C[N+]2=C(C=C3N1C4=CC=CC=C4S3)SC5=CC=CC=C52.[Br-]