8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

C98H73F3N12O16S6 — CID 158715901

IUPAC8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
SMILESCOc1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2.COc1cc2cccnc2c2c1-c1ccccc1S(=O)(=O)N2.COc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O.COc1ccnc2c3c(ccc12)-c1cc(C(F)(F)F)ccc1S(=O)(=O)N3.Cc1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2.Cc1cc2c(cc1C)S(=O)(=O)Nc1c-2ccc2cccnc12
InChIInChI=1S/C17H11F3N2O3S.C17H14N2O2S.3C16H12N2O3S.C16H12N2O2S/c1-25-13-6-7-21-15-11(13)4-3-10-12-8-9(17(18,19)20)2-5-14(12)26(23,24)22-16(10)15;1-10-8-14-13-6-5-12-4-3-7-18-16(12)17(13)19-22(20,21)15(14)9-11(10)2;1-21-11-5-7-14-13(9-11)12-6-4-10-3-2-8-17-15(10)16(12)18-22(14,19)20;1-21-12-9-10-5-4-8-17-15(10)16-14(12)11-6-2-3-7-13(11)22(19,20)18-16;1-21-13-9-12-10-5-2-3-7-14(10)22(19,20)18-16(12)15-11(13)6-4-8-17-15;1-10-9-13-12-5-2-3-7-14(12)21(19,20)18-16(13)15-11(10)6-4-8-17-15/h2-8,22H,1H3;3-9,19H,1-2H3;3*2-9,18H,1H3;2-9,18H,1H3
InChIKeyIJHPWNNEEQPRTL-UHFFFAOYSA-N
MW1924.13 g/mol
LogP20.07
Rot. Bonds4

About 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide (PubChem CID 158715901) has the molecular formula C98H73F3N12O16S6 and a molecular weight of 1924.13 g/mol. Its IUPAC name is 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide.

Molecular Properties

Compound Name8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
PubChem CID158715901
Molecular FormulaC98H73F3N12O16S6
Molecular Weight1924.13 g/mol
Exact Mass1922.35
IUPAC Name8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
SMILESCOc1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2.COc1cc2cccnc2c2c1-c1ccccc1S(=O)(=O)N2.COc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O.COc1ccnc2c3c(ccc12)-c1cc(C(F)(F)F)ccc1S(=O)(=O)N3.Cc1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2.Cc1cc2c(cc1C)S(=O)(=O)Nc1c-2ccc2cccnc12
InChIInChI=1S/C17H11F3N2O3S.C17H14N2O2S.3C16H12N2O3S.C16H12N2O2S/c1-25-13-6-7-21-15-11(13)4-3-10-12-8-9(17(18,19)20)2-5-14(12)26(23,24)22-16(10)15;1-10-8-14-13-6-5-12-4-3-7-18-16(12)17(13)19-22(20,21)15(14)9-11(10)2;1-21-11-5-7-14-13(9-11)12-6-4-10-3-2-8-17-15(10)16(12)18-22(14,19)20;1-21-12-9-10-5-4-8-17-15(10)16-14(12)11-6-2-3-7-13(11)22(19,20)18-16;1-21-13-9-12-10-5-2-3-7-14(10)22(19,20)18-16(12)15-11(13)6-4-8-17-15;1-10-9-13-12-5-2-3-7-14(12)21(19,20)18-16(13)15-11(10)6-4-8-17-15/h2-8,22H,1H3;3-9,19H,1-2H3;3*2-9,18H,1H3;2-9,18H,1H3
InChIKeyIJHPWNNEEQPRTL-UHFFFAOYSA-N
XLogP20.07
TPSA391.28 Ų
H-Bond Donors6
H-Bond Acceptors22
Rotatable Bonds4
Heavy Atoms135
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001924.13
LogP ≤ 520.07
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1022

Analyze 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide with MolForge

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Related Compounds

12-Methoxy-9-trifluoromethyl-5H-6-thia-4,5-diaza-chrysene 6,6-dioxide
CID 68183336
11-methoxy-9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 16759968
12-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine
CID 126516460
3-(difluoromethoxy)-N-quinolin-8-ylbenzenesulfonamide;2,4-dimethoxy-N-quinolin-8-ylbenzenesulfonamide;N-quinolin-8-ylnaphthalene-2-sulfonamide;N-quinolin-8-yl-3-(trifluoromethoxy)benzenesulfonamide;N-quinolin-8-yl-2-(trifluoromethyl)benzenesulfonamide;N-quinolin-8-yl-4-(trifluoromethyl)benzenesulfonamide
CID 157340818
N-(6-fluoroquinolin-8-yl)pyridine-2-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-2-sulfonamide;N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-2-sulfonamide;6-(trifluoromethyl)-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide
CID 157917089
Acetic acid;tris(fluoropalladium(1+));bis((5-methoxy-2-pyridin-2-ylphenyl)-(4-methylphenyl)sulfonylazanide);(4-methylphenyl)sulfonyl-(3-methyl-2-pyridin-2-ylphenyl)azanide;(4-methylphenyl)sulfonyl-(4-methyl-2-pyridin-2-ylphenyl)azanide;bis((4-methylphenyl)sulfonyl-[2-pyridin-2-yl-5-(trifluoromethyl)phenyl]azanide);tris(palladium);hexakis(pyridine)
CID 158222638
1-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;N-(5-morpholin-4-ylquinolin-8-yl)benzenesulfonamide
CID 158528441
Acetic acid;tris(fluoropalladium(1+));[5-methoxy-3-methyl-2-(5-methyl-2-pyridinyl)phenyl]-(4-methylphenyl)sulfonylazanide;[5-methoxy-2-(5-methyl-2-pyridinyl)phenyl]-(4-methylphenyl)sulfonylazanide;(4-methylphenyl)sulfonyl-(3-methyl-2-pyridin-2-ylphenyl)azanide;(4-methylphenyl)sulfonyl-(2-pyridin-2-ylphenyl)azanide;bis((4-methylphenyl)sulfonyl-[2-pyridin-2-yl-5-(trifluoromethyl)phenyl]azanide);tris(palladium);hexakis(pyridine)
CID 158619935
6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide
CID 159138432
2-amino-N-(5-chloroquinolin-8-yl)-4-methylbenzenesulfonamide;2-amino-N-(6-methoxyquinolin-8-yl)-4-methylbenzenesulfonamide;N-(5,6-dimethylquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(6-methylquinolin-8-yl)benzenesulfonamide;9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 159223835
N-(4-methoxyquinolin-8-yl)benzenesulfonamide;N-(5-methylquinolin-8-yl)benzenesulfonamide;N-quinolin-8-ylquinoline-3-sulfonamide;N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide;N-[5-(trifluoromethyl)quinolin-8-yl]benzenesulfonamide
CID 160260945
1-(6,6-dioxo-5H-quinolino[8,7-c][1,2]benzothiazin-12-yl)ethanol;1-(6,6-dioxo-5H-quinolino[8,7-c][1,2]benzothiazin-12-yl)-2-morpholin-4-ylethanone;1-(6,6-dioxo-5H-quinolino[8,7-c][1,2]benzothiazin-12-yl)-4-piperidin-1-ylbutan-1-one;1-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 160608208

Frequently Asked Questions

What is the IUPAC name of 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The IUPAC name of 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide (CID 158715901) is 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide.
What is the SMILES notation for 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The canonical SMILES for 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide is COc1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2.COc1cc2cccnc2c2c1-c1ccccc1S(=O)(=O)N2.COc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O.COc1ccnc2c3c(ccc12)-c1cc(C(F)(F)F)ccc1S(=O)(=O)N3.Cc1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2.Cc1cc2c(cc1C)S(=O)(=O)Nc1c-2ccc2cccnc12.
What is the InChIKey of 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The InChIKey is IJHPWNNEEQPRTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N2O3S.C17H14N2O2S.3C16H12N2O3S.C16H12N2O2S/c1-25-13-6-7-21-15-11(13)4-3-10-12-8-9(17(18,19)20)2-5-14(12)26(23,24)22-16(10)15;1-10-8-14-13-6-5-12-4-3-7-18-16(12)17(13)19-22(20,21)15(14)9-11(10)2;1-21-11-5-7-14-13(9-11)12-6-4-10-3-2-8-17-15(10)16(12)18-22(14,19)20;1-21-12-9-10-5-4-8-17-15(10)16-14(12)11-6-2-3-7-13(11)22(19,20)18-16;1-21-13-9-12-10-5-2-3-7-14(10)22(19,20)18-16(12)15-11(13)6-4-8-17-15;1-10-9-13-12-5-2-3-7-14(12)21(19,20)18-16(13)15-11(10)6-4-8-17-15/h2-8,22H,1H3;3-9,19H,1-2H3;3*2-9,18H,1H3;2-9,18H,1H3.
What are the key properties of 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide has a molecular weight of 1924.13 g/mol, XLogP of 20.07, 4 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide is sourced from PubChem (CID 158715901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).