AC1MHFRT

diethyl-methyl-(2-pyrido[3,2-b][1,4]benzothiazin-10-ylethyl)azanium;methyl sulfate

Also Known As: D 252|Ammonium, diethylmethyl(2-(10H-pyrido(3,2-b)(1,4)benzothiazin-10-yl)ethyl)-, methyl sulfate|diethyl-methyl-(2-pyrido[3,2-b][1,4]benzothiazin-10-ylethyl)azanium; methyl sulfate|10H-Pyrido[3,2-b][1,4]benzothiazine-10-ethanaminium, N,N-diethyl-N-methyl-, methyl sulfate|N,N-Diethyl-N-methyl-2-(10H-pyrido[3,2-b][1,4]benzothiazin-10-yl)ethan-1-aminium methyl sulfate

Molecular Formula	C19H27N3O4S2
Molecular Weight	425.1443 g/mol
LogP	3.2637
Topological Polar Surface Area	82.56 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	425.1443
Monoisotopic Mass	425.1443
Heavy Atoms	28
Complexity	840.7524

Chemical Identifiers

CAS Number	66903-00-2
SMILES	CC[N+](C)(CC)CCN1C2=CC=CC=C2SC3=C1N=CC=C3.COS(=O)(=O)[O-]