4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol

C124H112Cl6N20O7 — CID 161461662

About 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol

4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol (PubChem CID 161461662) has the molecular formula C124H112Cl6N20O7 and a molecular weight of 2207.11 g/mol. Its IUPAC name is 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol.

Molecular Properties

• Compound Name: 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol
• PubChem CID: 161461662
• Molecular Formula: C124H112Cl6N20O7
• Molecular Weight: 2207.11 g/mol
• Exact Mass: 2202.72
• IUPAC Name: 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol
• SMILES: COc1ccc(Nc2nc(Cc3cccc(CO)c3)nc(Cc3cccc(OC)c3)n2)cc1.COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3cccc(Cl)c3)n2)c1.COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1cccc(Nc2nc(Cc3cccc(Cl)c3)nc(Cc3cccc(Cl)c3)n2)c1.Cc1ccccc1Nc1nc(Cc2cccc(Cl)c2)nc(Cc2cccc(Cl)c2)n1
• InChI: InChI=1S/C26H26N4O3.2C25H23ClN4O2.2C24H20Cl2N4/c1-32-22-11-9-21(10-12-22)27-26-29-24(15-18-5-3-7-20(13-18)17-31)28-25(30-26)16-19-6-4-8-23(14-19)33-2;1-32-22-10-3-6-18(12-22)14-24-28-23(13-17-5-2-7-19(11-17)16-31)29-25(30-24)27-21-9-4-8-20(26)15-21;1-32-20-9-5-7-18(13-20)15-24-28-23(14-17-6-4-8-19(12-17)16-31)29-25(30-24)27-22-11-3-2-10-21(22)26;1-16-5-2-10-21(11-16)27-24-29-22(14-17-6-3-8-19(25)12-17)28-23(30-24)15-18-7-4-9-20(26)13-18;1-16-6-2-3-11-21(16)27-24-29-22(14-17-7-4-9-19(25)12-17)28-23(30-24)15-18-8-5-10-20(26)13-18/h3-14,31H,15-17H2,1-2H3,(H,27,28,29,30);2-12,15,31H,13-14,16H2,1H3,(H,27,28,29,30);2-13,31H,14-16H2,1H3,(H,27,28,29,30);2*2-13H,14-15H2,1H3,(H,27,28,29,30)
• InChIKey: WBWYLGASQCHPLH-UHFFFAOYSA-N
• XLogP: 27.03
• TPSA: 351.11 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 27
• Rotatable Bonds: 37
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2207.11
LogP ≤ 5	27.03
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol?

The IUPAC name of 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol (CID 161461662) is 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol.

What is the SMILES notation for 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol?

The canonical SMILES for 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol is COc1ccc(Nc2nc(Cc3cccc(CO)c3)nc(Cc3cccc(OC)c3)n2)cc1.COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3cccc(Cl)c3)n2)c1.COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1cccc(Nc2nc(Cc3cccc(Cl)c3)nc(Cc3cccc(Cl)c3)n2)c1.Cc1ccccc1Nc1nc(Cc2cccc(Cl)c2)nc(Cc2cccc(Cl)c2)n1.

What is the InChIKey of 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol?

The InChIKey is WBWYLGASQCHPLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O3.2C25H23ClN4O2.2C24H20Cl2N4/c1-32-22-11-9-21(10-12-22)27-26-29-24(15-18-5-3-7-20(13-18)17-31)28-25(30-26)16-19-6-4-8-23(14-19)33-2;1-32-22-10-3-6-18(12-22)14-24-28-23(13-17-5-2-7-19(11-17)16-31)29-25(30-24)27-21-9-4-8-20(26)15-21;1-32-20-9-5-7-18(13-20)15-24-28-23(14-17-6-4-8-19(12-17)16-31)29-25(30-24)27-22-11-3-2-10-21(22)26;1-16-5-2-10-21(11-16)27-24-29-22(14-17-6-3-8-19(25)12-17)28-23(30-24)15-18-7-4-9-20(26)13-18;1-16-6-2-3-11-21(16)27-24-29-22(14-17-7-4-9-19(25)12-17)28-23(30-24)15-18-8-5-10-20(26)13-18/h3-14,31H,15-17H2,1-2H3,(H,27,28,29,30);2-12,15,31H,13-14,16H2,1H3,(H,27,28,29,30);2-13,31H,14-16H2,1H3,(H,27,28,29,30);2*2-13H,14-15H2,1H3,(H,27,28,29,30).

What are the key properties of 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol?

4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol has a molecular weight of 2207.11 g/mol, XLogP of 27.03, 37 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 4,6-bis[(3-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3,5-triazin-2-amine;4,6-bis[(3-chlorophenyl)methyl]-N-(3-methylphenyl)-1,3,5-triazin-2-amine;[3-[[4-(2-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(3-chloroanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol;[3-[[4-(4-methoxyanilino)-6-[(3-methoxyphenyl)methyl]-1,3,5-triazin-2-yl]methyl]phenyl]methanol is sourced from PubChem (CID 161461662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).