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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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

C122H106Cl8N20O4 — CID 157147787

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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 (PubChem CID 157147787) has the molecular formula C122H106Cl8N20O4 and a molecular weight of 2199.95 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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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.

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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
• PubChem CID: 157147787
• Molecular Formula: C122H106Cl8N20O4
• Molecular Weight: 2199.95 g/mol
• Exact Mass: 2194.62
• 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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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
• SMILES: COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3cccc(Cl)c3)n2)c1.COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1ccc(Nc2nc(Cc3cccc(Cl)c3)nc(Cc3cccc(Cl)c3)n2)cc1.Cc1cccc(Nc2nc(Cc3cccc(Cl)c3)nc(Cc3cccc(Cl)c3)n2)c1.Cc1ccccc1Nc1nc(Cc2cccc(Cl)c2)nc(Cc2cccc(Cl)c2)n1
• InChI: InChI=1S/2C25H23ClN4O2.3C24H20Cl2N4/c1-32-22-10-3-6-18(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;1-16-8-10-21(11-9-16)27-24-29-22(14-17-4-2-6-19(25)12-17)28-23(30-24)15-18-5-3-7-20(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/h2-12,15,31H,13-14,16H2,1H3,(H,27,28,29,30);2-13,31H,14-16H2,1H3,(H,27,28,29,30);3*2-13H,14-15H2,1H3,(H,27,28,29,30)
• InChIKey: AKXCBEIENKGSKQ-UHFFFAOYSA-N
• XLogP: 29.14
• TPSA: 312.42 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 24
• Rotatable Bonds: 34
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2199.95
LogP ≤ 5	29.14
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	24

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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?

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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 (CID 157147787) 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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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.

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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?

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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 is COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3cccc(Cl)c3)n2)c1.COc1cccc(Cc2nc(Cc3cccc(CO)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1ccc(Nc2nc(Cc3cccc(Cl)c3)nc(Cc3cccc(Cl)c3)n2)cc1.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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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?

The InChIKey is AKXCBEIENKGSKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H23ClN4O2.3C24H20Cl2N4/c1-32-22-10-3-6-18(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;1-16-8-10-21(11-9-16)27-24-29-22(14-17-4-2-6-19(25)12-17)28-23(30-24)15-18-5-3-7-20(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/h2-12,15,31H,13-14,16H2,1H3,(H,27,28,29,30);2-13,31H,14-16H2,1H3,(H,27,28,29,30);3*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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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?

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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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 has a molecular weight of 2199.95 g/mol, XLogP of 29.14, 34 rotatable bonds, 7 hydrogen bond donors, and 24 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;4,6-bis[(3-chlorophenyl)methyl]-N-(4-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 is sourced from PubChem (CID 157147787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).