N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide

C69H60F3N25O11S4 — CID 157407730

IUPACN-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide
SMILESCNC(=O)c1ccc(S(=O)(=O)Nc2nc(C)nc(-c3ccccn3)n2)cc1.Cc1nc(NS(=O)(=O)c2ccc(-c3ccn(C)n3)cc2)nc(-c2ccccn2)n1.Cc1nc(NS(=O)(=O)c2ccc(C(=O)NC(F)(F)F)cc2)nc(-c2ccccn2)n1.Cc1nc(NS(=O)(=O)c2ccc(C(N)=O)cc2)nc(-c2ccccn2)n1
InChIInChI=1S/C19H17N7O2S.C17H13F3N6O3S.C17H16N6O3S.C16H14N6O3S/c1-13-21-18(17-5-3-4-11-20-17)23-19(22-13)25-29(27,28)15-8-6-14(7-9-15)16-10-12-26(2)24-16;1-10-22-14(13-4-2-3-9-21-13)24-16(23-10)26-30(28,29)12-7-5-11(6-8-12)15(27)25-17(18,19)20;1-11-20-15(14-5-3-4-10-19-14)22-17(21-11)23-27(25,26)13-8-6-12(7-9-13)16(24)18-2;1-10-19-15(13-4-2-3-9-18-13)21-16(20-10)22-26(24,25)12-7-5-11(6-8-12)14(17)23/h3-12H,1-2H3,(H,21,22,23,25);2-9H,1H3,(H,25,27)(H,22,23,24,26);3-10H,1-2H3,(H,18,24)(H,20,21,22,23);2-9H,1H3,(H2,17,23)(H,19,20,21,22)
InChIKeyBNXNSSKQABEGPJ-UHFFFAOYSA-N
MW1600.66 g/mol
LogP7.28
Rot. Bonds20

About N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide

N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide (PubChem CID 157407730) has the molecular formula C69H60F3N25O11S4 and a molecular weight of 1600.66 g/mol. Its IUPAC name is N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide
PubChem CID157407730
Molecular FormulaC69H60F3N25O11S4
Molecular Weight1600.66 g/mol
Exact Mass1599.37
IUPAC NameN-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide
SMILESCNC(=O)c1ccc(S(=O)(=O)Nc2nc(C)nc(-c3ccccn3)n2)cc1.Cc1nc(NS(=O)(=O)c2ccc(-c3ccn(C)n3)cc2)nc(-c2ccccn2)n1.Cc1nc(NS(=O)(=O)c2ccc(C(=O)NC(F)(F)F)cc2)nc(-c2ccccn2)n1.Cc1nc(NS(=O)(=O)c2ccc(C(N)=O)cc2)nc(-c2ccccn2)n1
InChIInChI=1S/C19H17N7O2S.C17H13F3N6O3S.C17H16N6O3S.C16H14N6O3S/c1-13-21-18(17-5-3-4-11-20-17)23-19(22-13)25-29(27,28)15-8-6-14(7-9-15)16-10-12-26(2)24-16;1-10-22-14(13-4-2-3-9-21-13)24-16(23-10)26-30(28,29)12-7-5-11(6-8-12)15(27)25-17(18,19)20;1-11-20-15(14-5-3-4-10-19-14)22-17(21-11)23-27(25,26)13-8-6-12(7-9-13)16(24)18-2;1-10-19-15(13-4-2-3-9-18-13)21-16(20-10)22-26(24,25)12-7-5-11(6-8-12)14(17)23/h3-12H,1-2H3,(H,21,22,23,25);2-9H,1H3,(H,25,27)(H,22,23,24,26);3-10H,1-2H3,(H,18,24)(H,20,21,22,23);2-9H,1H3,(H2,17,23)(H,19,20,21,22)
InChIKeyBNXNSSKQABEGPJ-UHFFFAOYSA-N
XLogP7.28
TPSA510.03 Ų
H-Bond Donors7
H-Bond Acceptors29
Rotatable Bonds20
Heavy Atoms112
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001600.66
LogP ≤ 57.28
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide?
The IUPAC name of N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide (CID 157407730) is N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide.
What is the SMILES notation for N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide?
The canonical SMILES for N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide is CNC(=O)c1ccc(S(=O)(=O)Nc2nc(C)nc(-c3ccccn3)n2)cc1.Cc1nc(NS(=O)(=O)c2ccc(-c3ccn(C)n3)cc2)nc(-c2ccccn2)n1.Cc1nc(NS(=O)(=O)c2ccc(C(=O)NC(F)(F)F)cc2)nc(-c2ccccn2)n1.Cc1nc(NS(=O)(=O)c2ccc(C(N)=O)cc2)nc(-c2ccccn2)n1.
What is the InChIKey of N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide?
The InChIKey is BNXNSSKQABEGPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O2S.C17H13F3N6O3S.C17H16N6O3S.C16H14N6O3S/c1-13-21-18(17-5-3-4-11-20-17)23-19(22-13)25-29(27,28)15-8-6-14(7-9-15)16-10-12-26(2)24-16;1-10-22-14(13-4-2-3-9-21-13)24-16(23-10)26-30(28,29)12-7-5-11(6-8-12)15(27)25-17(18,19)20;1-11-20-15(14-5-3-4-10-19-14)22-17(21-11)23-27(25,26)13-8-6-12(7-9-13)16(24)18-2;1-10-19-15(13-4-2-3-9-18-13)21-16(20-10)22-26(24,25)12-7-5-11(6-8-12)14(17)23/h3-12H,1-2H3,(H,21,22,23,25);2-9H,1H3,(H,25,27)(H,22,23,24,26);3-10H,1-2H3,(H,18,24)(H,20,21,22,23);2-9H,1H3,(H2,17,23)(H,19,20,21,22).
What are the key properties of N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide?
N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide has a molecular weight of 1600.66 g/mol, XLogP of 7.28, 20 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-(1-methylpyrazol-3-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzenesulfonamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]benzamide;4-[(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)sulfamoyl]-N-(trifluoromethyl)benzamide is sourced from PubChem (CID 157407730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).