4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide

C92H65ClF11N13O14S6 — CID 162231959

IUPAC4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide
SMILESCCOc1cc(NS(=O)(=O)c2ccccc2)c2ncccc2c1.O=S(=O)(Nc1cc(F)c(F)c2cccnc12)c1ccccc1.O=S(=O)(Nc1cc(F)cc2cccnc12)c1c(F)cccc1F.O=S(=O)(Nc1cc(F)cc2cccnc12)c1ccc(Cl)cc1F.O=S(=O)(Nc1cc(F)cc2cccnc12)c1cccnc1.O=S(=O)(Nc1cc(OC(F)(F)F)cc2cccnc12)c1ccccc1
InChIInChI=1S/C17H16N2O3S.C16H11F3N2O3S.C15H9ClF2N2O2S.C15H9F3N2O2S.C15H10F2N2O2S.C14H10FN3O2S/c1-2-22-14-11-13-7-6-10-18-17(13)16(12-14)19-23(20,21)15-8-4-3-5-9-15;17-16(18,19)24-12-9-11-5-4-8-20-15(11)14(10-12)21-25(22,23)13-6-2-1-3-7-13;16-10-3-4-14(12(18)7-10)23(21,22)20-13-8-11(17)6-9-2-1-5-19-15(9)13;16-10-7-9-3-2-6-19-14(9)13(8-10)20-23(21,22)15-11(17)4-1-5-12(15)18;16-12-9-13(15-11(14(12)17)7-4-8-18-15)19-22(20,21)10-5-2-1-3-6-10;15-11-7-10-3-1-6-17-14(10)13(8-11)18-21(19,20)12-4-2-5-16-9-12/h3-12,19H,2H2,1H3;1-10,21H;2*1-8,20H;1-9,19H;1-9,18H
InChIKeyZVNWVPASKXQXCI-UHFFFAOYSA-N
MW2013.44 g/mol
LogP20.67
Rot. Bonds21

About 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide

4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide (PubChem CID 162231959) has the molecular formula C92H65ClF11N13O14S6 and a molecular weight of 2013.44 g/mol. Its IUPAC name is 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide
PubChem CID162231959
Molecular FormulaC92H65ClF11N13O14S6
Molecular Weight2013.44 g/mol
Exact Mass2011.26
IUPAC Name4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide
SMILESCCOc1cc(NS(=O)(=O)c2ccccc2)c2ncccc2c1.O=S(=O)(Nc1cc(F)c(F)c2cccnc12)c1ccccc1.O=S(=O)(Nc1cc(F)cc2cccnc12)c1c(F)cccc1F.O=S(=O)(Nc1cc(F)cc2cccnc12)c1ccc(Cl)cc1F.O=S(=O)(Nc1cc(F)cc2cccnc12)c1cccnc1.O=S(=O)(Nc1cc(OC(F)(F)F)cc2cccnc12)c1ccccc1
InChIInChI=1S/C17H16N2O3S.C16H11F3N2O3S.C15H9ClF2N2O2S.C15H9F3N2O2S.C15H10F2N2O2S.C14H10FN3O2S/c1-2-22-14-11-13-7-6-10-18-17(13)16(12-14)19-23(20,21)15-8-4-3-5-9-15;17-16(18,19)24-12-9-11-5-4-8-20-15(11)14(10-12)21-25(22,23)13-6-2-1-3-7-13;16-10-3-4-14(12(18)7-10)23(21,22)20-13-8-11(17)6-9-2-1-5-19-15(9)13;16-10-7-9-3-2-6-19-14(9)13(8-10)20-23(21,22)15-11(17)4-1-5-12(15)18;16-12-9-13(15-11(14(12)17)7-4-8-18-15)19-22(20,21)10-5-2-1-3-6-10;15-11-7-10-3-1-6-17-14(10)13(8-11)18-21(19,20)12-4-2-5-16-9-12/h3-12,19H,2H2,1H3;1-10,21H;2*1-8,20H;1-9,19H;1-9,18H
InChIKeyZVNWVPASKXQXCI-UHFFFAOYSA-N
XLogP20.67
TPSA385.71 Ų
H-Bond Donors6
H-Bond Acceptors21
Rotatable Bonds21
Heavy Atoms137
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002013.44
LogP ≤ 520.67
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1021

Analyze 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide?
The IUPAC name of 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide (CID 162231959) is 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide.
What is the SMILES notation for 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide?
The canonical SMILES for 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide is CCOc1cc(NS(=O)(=O)c2ccccc2)c2ncccc2c1.O=S(=O)(Nc1cc(F)c(F)c2cccnc12)c1ccccc1.O=S(=O)(Nc1cc(F)cc2cccnc12)c1c(F)cccc1F.O=S(=O)(Nc1cc(F)cc2cccnc12)c1ccc(Cl)cc1F.O=S(=O)(Nc1cc(F)cc2cccnc12)c1cccnc1.O=S(=O)(Nc1cc(OC(F)(F)F)cc2cccnc12)c1ccccc1.
What is the InChIKey of 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide?
The InChIKey is ZVNWVPASKXQXCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3S.C16H11F3N2O3S.C15H9ClF2N2O2S.C15H9F3N2O2S.C15H10F2N2O2S.C14H10FN3O2S/c1-2-22-14-11-13-7-6-10-18-17(13)16(12-14)19-23(20,21)15-8-4-3-5-9-15;17-16(18,19)24-12-9-11-5-4-8-20-15(11)14(10-12)21-25(22,23)13-6-2-1-3-7-13;16-10-3-4-14(12(18)7-10)23(21,22)20-13-8-11(17)6-9-2-1-5-19-15(9)13;16-10-7-9-3-2-6-19-14(9)13(8-10)20-23(21,22)15-11(17)4-1-5-12(15)18;16-12-9-13(15-11(14(12)17)7-4-8-18-15)19-22(20,21)10-5-2-1-3-6-10;15-11-7-10-3-1-6-17-14(10)13(8-11)18-21(19,20)12-4-2-5-16-9-12/h3-12,19H,2H2,1H3;1-10,21H;2*1-8,20H;1-9,19H;1-9,18H.
What are the key properties of 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide?
4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide has a molecular weight of 2013.44 g/mol, XLogP of 20.67, 21 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-fluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;2,6-difluoro-N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(5,6-difluoroquinolin-8-yl)benzenesulfonamide;N-(6-ethoxyquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]benzenesulfonamide is sourced from PubChem (CID 162231959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).