4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide

C71H59Cl3N24O9S2 — CID 159979627

About 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide

4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide (PubChem CID 159979627) has the molecular formula C71H59Cl3N24O9S2 and a molecular weight of 1562.90 g/mol. Its IUPAC name is 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide.

Molecular Properties

• Compound Name: 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide
• PubChem CID: 159979627
• Molecular Formula: C71H59Cl3N24O9S2
• Molecular Weight: 1562.90 g/mol
• Exact Mass: 1560.34
• IUPAC Name: 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide
• SMILES: CC(=O)Nc1ccc(C(=O)Nc2ncnc(-c3ccccn3)n2)c(Cl)c1.CN1CCN(Cc2ccc(C(=O)Nc3ncnc(-c4ccccn4)n3)cc2)CC1.CS(=O)(=O)c1ccc(C(=O)Nc2nc(C#N)nc(-c3ccccn3)n2)c(Cl)c1.CS(=O)(=O)c1ccc(C(=O)Nc2ncnc(-c3ccccn3)n2)c(Cl)c1
• InChI: InChI=1S/C21H23N7O.C17H11ClN6O3S.C17H13ClN6O2.C16H12ClN5O3S/c1-27-10-12-28(13-11-27)14-16-5-7-17(8-6-16)20(29)26-21-24-15-23-19(25-21)18-4-2-3-9-22-18;1-28(26,27)10-5-6-11(12(18)8-10)16(25)24-17-22-14(9-19)21-15(23-17)13-4-2-3-7-20-13;1-10(25)22-11-5-6-12(13(18)8-11)16(26)24-17-21-9-20-15(23-17)14-4-2-3-7-19-14;1-26(24,25)10-5-6-11(12(17)8-10)15(23)22-16-20-9-19-14(21-16)13-4-2-3-7-18-13/h2-9,15H,10-14H2,1H3,(H,23,24,25,26,29);2-8H,1H3,(H,21,22,23,24,25);2-9H,1H3,(H,22,25)(H,20,21,23,24,26);2-9H,1H3,(H,19,20,21,22,23)
• InChIKey: OFOYQCFRXKMXJB-UHFFFAOYSA-N
• XLogP: 9.09
• TPSA: 450.29 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 28
• Rotatable Bonds: 17
• Heavy Atoms: 109
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1562.90
LogP ≤ 5	9.09
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide?

The IUPAC name of 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide (CID 159979627) is 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide.

What is the SMILES notation for 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide?

The canonical SMILES for 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide is CC(=O)Nc1ccc(C(=O)Nc2ncnc(-c3ccccn3)n2)c(Cl)c1.CN1CCN(Cc2ccc(C(=O)Nc3ncnc(-c4ccccn4)n3)cc2)CC1.CS(=O)(=O)c1ccc(C(=O)Nc2nc(C#N)nc(-c3ccccn3)n2)c(Cl)c1.CS(=O)(=O)c1ccc(C(=O)Nc2ncnc(-c3ccccn3)n2)c(Cl)c1.

What is the InChIKey of 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide?

The InChIKey is OFOYQCFRXKMXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N7O.C17H11ClN6O3S.C17H13ClN6O2.C16H12ClN5O3S/c1-27-10-12-28(13-11-27)14-16-5-7-17(8-6-16)20(29)26-21-24-15-23-19(25-21)18-4-2-3-9-22-18;1-28(26,27)10-5-6-11(12(18)8-10)16(25)24-17-22-14(9-19)21-15(23-17)13-4-2-3-7-20-13;1-10(25)22-11-5-6-12(13(18)8-11)16(26)24-17-21-9-20-15(23-17)14-4-2-3-7-19-14;1-26(24,25)10-5-6-11(12(17)8-10)15(23)22-16-20-9-19-14(21-16)13-4-2-3-7-18-13/h2-9,15H,10-14H2,1H3,(H,23,24,25,26,29);2-8H,1H3,(H,21,22,23,24,25);2-9H,1H3,(H,22,25)(H,20,21,23,24,26);2-9H,1H3,(H,19,20,21,22,23).

What are the key properties of 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide?

4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide has a molecular weight of 1562.90 g/mol, XLogP of 9.09, 17 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 4-acetamido-2-chloro-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-cyano-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide;2-chloro-4-methylsulfonyl-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-[(4-methylpiperazin-1-yl)methyl]-N-(4-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide is sourced from PubChem (CID 159979627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).