N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide

C78H62N10O11S4 — CID 158454080

IUPACN-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccc(C)cc23)cc1.Cc1ccc(-c2cc(C(=O)Nc3ccc(S(=O)(=O)Nc4nccs4)cc3)c3ccccc3n2)o1.Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(-c4ccccc4)nc4ccccc34)cc2)c1
InChIInChI=1S/C29H23N3O3S.C25H21N3O4S.C24H18N4O4S2/c1-20-8-7-11-23(18-20)32-36(34,35)24-16-14-22(15-17-24)30-29(33)26-19-28(21-9-3-2-4-10-21)31-27-13-6-5-12-25(26)27;1-16-8-13-23-21(14-16)22(15-24(27-23)18-6-4-3-5-7-18)25(30)26-19-9-11-20(12-10-19)33(31,32)28-17(2)29;1-15-6-11-22(32-15)21-14-19(18-4-2-3-5-20(18)27-21)23(29)26-16-7-9-17(10-8-16)34(30,31)28-24-25-12-13-33-24/h2-19,32H,1H3,(H,30,33);3-15H,1-2H3,(H,26,30)(H,28,29);2-14H,1H3,(H,25,28)(H,26,29)
InChIKeyHEIWKAKYZFDSMR-UHFFFAOYSA-N
MW1443.68 g/mol
LogP15.86
Rot. Bonds17

About N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide

N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide (PubChem CID 158454080) has the molecular formula C78H62N10O11S4 and a molecular weight of 1443.68 g/mol. Its IUPAC name is N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide
PubChem CID158454080
Molecular FormulaC78H62N10O11S4
Molecular Weight1443.68 g/mol
Exact Mass1442.35
IUPAC NameN-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccc(C)cc23)cc1.Cc1ccc(-c2cc(C(=O)Nc3ccc(S(=O)(=O)Nc4nccs4)cc3)c3ccccc3n2)o1.Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(-c4ccccc4)nc4ccccc34)cc2)c1
InChIInChI=1S/C29H23N3O3S.C25H21N3O4S.C24H18N4O4S2/c1-20-8-7-11-23(18-20)32-36(34,35)24-16-14-22(15-17-24)30-29(33)26-19-28(21-9-3-2-4-10-21)31-27-13-6-5-12-25(26)27;1-16-8-13-23-21(14-16)22(15-24(27-23)18-6-4-3-5-7-18)25(30)26-19-9-11-20(12-10-19)33(31,32)28-17(2)29;1-15-6-11-22(32-15)21-14-19(18-4-2-3-5-20(18)27-21)23(29)26-16-7-9-17(10-8-16)34(30,31)28-24-25-12-13-33-24/h2-19,32H,1H3,(H,30,33);3-15H,1-2H3,(H,26,30)(H,28,29);2-14H,1H3,(H,25,28)(H,26,29)
InChIKeyHEIWKAKYZFDSMR-UHFFFAOYSA-N
XLogP15.86
TPSA307.58 Ų
H-Bond Donors6
H-Bond Acceptors16
Rotatable Bonds17
Heavy Atoms103
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001443.68
LogP ≤ 515.86
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1016

Analyze N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide with MolForge

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Related Compounds

2-(2-chlorophenyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide
CID 1220561
2-(4-methylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide
CID 1292635
2-(4-methoxyphenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide
CID 3672707
N-[4-(acetylsulfamoyl)phenyl]-2-(4-ethylphenyl)quinoline-4-carboxamide
CID 1358755
2-(4-fluorophenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide
CID 2439803
N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 1222302
methane;N-[4-(methylsulfamoyl)phenyl]-2-phenylquinoline-4-carboxamide
CID 160607746
N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2-(3-methylphenyl)quinoline-4-carboxamide
CID 1009544
N-(4-acetamidophenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 4863526
5-(benzenesulfonamido)-2-chloro-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide
CID 43909921
N-[4-(diethylamino)phenyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 3408470
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide
CID 4622213

Frequently Asked Questions

What is the IUPAC name of N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide (CID 158454080) is N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide is CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccc(C)cc23)cc1.Cc1ccc(-c2cc(C(=O)Nc3ccc(S(=O)(=O)Nc4nccs4)cc3)c3ccccc3n2)o1.Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(-c4ccccc4)nc4ccccc34)cc2)c1.
What is the InChIKey of N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide?
The InChIKey is HEIWKAKYZFDSMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H23N3O3S.C25H21N3O4S.C24H18N4O4S2/c1-20-8-7-11-23(18-20)32-36(34,35)24-16-14-22(15-17-24)30-29(33)26-19-28(21-9-3-2-4-10-21)31-27-13-6-5-12-25(26)27;1-16-8-13-23-21(14-16)22(15-24(27-23)18-6-4-3-5-7-18)25(30)26-19-9-11-20(12-10-19)33(31,32)28-17(2)29;1-15-6-11-22(32-15)21-14-19(18-4-2-3-5-20(18)27-21)23(29)26-16-7-9-17(10-8-16)34(30,31)28-24-25-12-13-33-24/h2-19,32H,1H3,(H,30,33);3-15H,1-2H3,(H,26,30)(H,28,29);2-14H,1H3,(H,25,28)(H,26,29).
What are the key properties of N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide?
N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide has a molecular weight of 1443.68 g/mol, XLogP of 15.86, 17 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(acetylsulfamoyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide;2-(5-methylfuran-2-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide;N-[4-[(3-methylphenyl)sulfamoyl]phenyl]-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 158454080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).