AC1LBTTK

3-benzyl-8,9-dimethoxy-4,4-dioxo-5,6-dihydro-4aH-benzo[f][1,2]benzothiazin-2-one

Also Known As: 3-Benzyl-8,9-dimethoxy-5,6-dihydro-3H-naphtho[1,2-E][1,2]thiazin-2(4ah)-one 4,4-dioxide|3H-Naphtho[1,2-e][1,2]thiazin-2(4aH)-one, 5,6-dihydro-8,9-dimethoxy-3-(phenylmethyl)-, 4,4-dioxide|3-benzyl-8,9-dimethoxy-4,4-dioxo-5,6-dihydro-4aH-benzo[f][1,2]benzothiazin-2-one|5,6-Dihydro-8,9-dimethoxy-3- -3H-naphtho[1,2-e][1,2]thiazin-2 -one4,4-dioxide|3-Benzyl-8,9-dimethoxy-5,6-dihydro-3H-naphtho[1,2-E][1,2]thiazin-2(4ah)-one 4,4-dioxide #

Molecular Formula	C21H21NO5S
Molecular Weight	399.11404 g/mol
LogP	2.4
Topological Polar Surface Area	81.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	399.11404
Monoisotopic Mass	399.11404
Heavy Atoms	28
Complexity	722.0

Chemical Identifiers

CAS Number	40535-18-0
SMILES	COC1=C(C=C2C(=C1)CCC3C2=CC(=O)N(S3(=O)=O)CC4=CC=CC=C4)OC
InChIKey	RIJXBFFBAPQJJA-UHFFFAOYSA-N