4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine

C114H102Cl6N30O7 — CID 158526444

IUPAC4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine
SMILESCOc1ccc(Nc2nc(Nc3cccc(OC)c3)nc(Nc3cccc(OC)c3)n2)cc1.COc1cccc(Nc2nc(Nc3cccc(Cl)c3)nc(Nc3cccc(OC)c3)n2)c1.COc1cccc(Nc2nc(Nc3cccc(OC)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(Cl)c3)nc(Nc3cccc(Cl)c3)n2)c1.Cc1ccccc1Nc1nc(Nc2cccc(Cl)c2)nc(Nc2cccc(Cl)c2)n1
InChIInChI=1S/C24H24N6O3.2C23H21ClN6O2.2C22H18Cl2N6/c1-31-19-12-10-16(11-13-19)25-22-28-23(26-17-6-4-8-20(14-17)32-2)30-24(29-22)27-18-7-5-9-21(15-18)33-3;1-31-19-10-4-8-17(13-19)26-22-28-21(25-16-7-3-6-15(24)12-16)29-23(30-22)27-18-9-5-11-20(14-18)32-2;1-31-17-9-5-7-15(13-17)25-21-28-22(26-16-8-6-10-18(14-16)32-2)30-23(29-21)27-20-12-4-3-11-19(20)24;1-14-5-2-8-17(11-14)25-20-28-21(26-18-9-3-6-15(23)12-18)30-22(29-20)27-19-10-4-7-16(24)13-19;1-14-6-2-3-11-19(14)27-22-29-20(25-17-9-4-7-15(23)12-17)28-21(30-22)26-18-10-5-8-16(24)13-18/h4-15H,1-3H3,(H3,25,26,27,28,29,30);2*3-14H,1-2H3,(H3,25,26,27,28,29,30);2*2-13H,1H3,(H3,25,26,27,28,29,30)
InChIKeyHMVOCUSCMZTNBN-UHFFFAOYSA-N
MW2216.99 g/mol
LogP30.11
Rot. Bonds37

About 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine

4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 158526444) has the molecular formula C114H102Cl6N30O7 and a molecular weight of 2216.99 g/mol. Its IUPAC name is 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID158526444
Molecular FormulaC114H102Cl6N30O7
Molecular Weight2216.99 g/mol
Exact Mass2212.67
IUPAC Name4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine
SMILESCOc1ccc(Nc2nc(Nc3cccc(OC)c3)nc(Nc3cccc(OC)c3)n2)cc1.COc1cccc(Nc2nc(Nc3cccc(Cl)c3)nc(Nc3cccc(OC)c3)n2)c1.COc1cccc(Nc2nc(Nc3cccc(OC)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(Cl)c3)nc(Nc3cccc(Cl)c3)n2)c1.Cc1ccccc1Nc1nc(Nc2cccc(Cl)c2)nc(Nc2cccc(Cl)c2)n1
InChIInChI=1S/C24H24N6O3.2C23H21ClN6O2.2C22H18Cl2N6/c1-31-19-12-10-16(11-13-19)25-22-28-23(26-17-6-4-8-20(14-17)32-2)30-24(29-22)27-18-7-5-9-21(15-18)33-3;1-31-19-10-4-8-17(13-19)26-22-28-21(25-16-7-3-6-15(24)12-16)29-23(30-22)27-18-9-5-11-20(14-18)32-2;1-31-17-9-5-7-15(13-17)25-21-28-22(26-16-8-6-10-18(14-16)32-2)30-23(29-21)27-20-12-4-3-11-19(20)24;1-14-5-2-8-17(11-14)25-20-28-21(26-18-9-3-6-15(23)12-18)30-22(29-20)27-19-10-4-7-16(24)13-19;1-14-6-2-3-11-19(14)27-22-29-20(25-17-9-4-7-15(23)12-17)28-21(30-22)26-18-10-5-8-16(24)13-18/h4-15H,1-3H3,(H3,25,26,27,28,29,30);2*3-14H,1-2H3,(H3,25,26,27,28,29,30);2*2-13H,1H3,(H3,25,26,27,28,29,30)
InChIKeyHMVOCUSCMZTNBN-UHFFFAOYSA-N
XLogP30.11
TPSA438.41 Ų
H-Bond Donors15
H-Bond Acceptors37
Rotatable Bonds37
Heavy Atoms157
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002216.99
LogP ≤ 530.11
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1037

Analyze 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine (CID 158526444) is 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine is COc1ccc(Nc2nc(Nc3cccc(OC)c3)nc(Nc3cccc(OC)c3)n2)cc1.COc1cccc(Nc2nc(Nc3cccc(Cl)c3)nc(Nc3cccc(OC)c3)n2)c1.COc1cccc(Nc2nc(Nc3cccc(OC)c3)nc(Nc3ccccc3Cl)n2)c1.Cc1cccc(Nc2nc(Nc3cccc(Cl)c3)nc(Nc3cccc(Cl)c3)n2)c1.Cc1ccccc1Nc1nc(Nc2cccc(Cl)c2)nc(Nc2cccc(Cl)c2)n1.
What is the InChIKey of 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is HMVOCUSCMZTNBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O3.2C23H21ClN6O2.2C22H18Cl2N6/c1-31-19-12-10-16(11-13-19)25-22-28-23(26-17-6-4-8-20(14-17)32-2)30-24(29-22)27-18-7-5-9-21(15-18)33-3;1-31-19-10-4-8-17(13-19)26-22-28-21(25-16-7-3-6-15(24)12-16)29-23(30-22)27-18-9-5-11-20(14-18)32-2;1-31-17-9-5-7-15(13-17)25-21-28-22(26-16-8-6-10-18(14-16)32-2)30-23(29-21)27-20-12-4-3-11-19(20)24;1-14-5-2-8-17(11-14)25-20-28-21(26-18-9-3-6-15(23)12-18)30-22(29-20)27-19-10-4-7-16(24)13-19;1-14-6-2-3-11-19(14)27-22-29-20(25-17-9-4-7-15(23)12-17)28-21(30-22)26-18-10-5-8-16(24)13-18/h4-15H,1-3H3,(H3,25,26,27,28,29,30);2*3-14H,1-2H3,(H3,25,26,27,28,29,30);2*2-13H,1H3,(H3,25,26,27,28,29,30).
What are the key properties of 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine?
4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 2216.99 g/mol, XLogP of 30.11, 37 rotatable bonds, 15 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-N-bis(3-chlorophenyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4,6-triamine;4-N,6-N-bis(3-chlorophenyl)-2-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-methoxyphenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N-(3-chlorophenyl)-4-N,6-N-bis(3-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 158526444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).