2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol

C114H89N15O13 — CID 160930847

IUPAC2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol
SMILESCC#COc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3O)n2)cc(OC)c1OC.COc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1.COc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3O)n2)cc1.COc1ccccc1-c1nc(-c2ccccc2O)nc(-c2ccccc2OC)n1.Oc1ccccc1-c1nc(Oc2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C26H21N3O4.C23H19N3O3.2C22H17N3O2.C21H15N3O2/c1-4-14-33-22-16-18(15-21(31-2)23(22)32-3)25-27-24(17-10-6-5-7-11-17)28-26(29-25)19-12-8-9-13-20(19)30;1-28-19-13-7-4-10-16(19)22-24-21(15-9-3-6-12-18(15)27)25-23(26-22)17-11-5-8-14-20(17)29-2;1-27-17-12-13-18(19(26)14-17)22-24-20(15-8-4-2-5-9-15)23-21(25-22)16-10-6-3-7-11-16;1-27-17-13-11-16(12-14-17)21-23-20(15-7-3-2-4-8-15)24-22(25-21)18-9-5-6-10-19(18)26;25-18-14-8-7-13-17(18)20-22-19(15-9-3-1-4-10-15)23-21(24-20)26-16-11-5-2-6-12-16/h5-13,15-16,30H,1-3H3;3-14,27H,1-2H3;2*2-14,26H,1H3;1-14,25H
InChIKeySTGANZHIFOHCHJ-UHFFFAOYSA-N
MW1877.06 g/mol
LogP23.43
Rot. Bonds23

About 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol

2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol (PubChem CID 160930847) has the molecular formula C114H89N15O13 and a molecular weight of 1877.06 g/mol. Its IUPAC name is 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol.

Molecular Properties

Compound Name2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol
PubChem CID160930847
Molecular FormulaC114H89N15O13
Molecular Weight1877.06 g/mol
Exact Mass1875.68
IUPAC Name2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol
SMILESCC#COc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3O)n2)cc(OC)c1OC.COc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1.COc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3O)n2)cc1.COc1ccccc1-c1nc(-c2ccccc2O)nc(-c2ccccc2OC)n1.Oc1ccccc1-c1nc(Oc2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C26H21N3O4.C23H19N3O3.2C22H17N3O2.C21H15N3O2/c1-4-14-33-22-16-18(15-21(31-2)23(22)32-3)25-27-24(17-10-6-5-7-11-17)28-26(29-25)19-12-8-9-13-20(19)30;1-28-19-13-7-4-10-16(19)22-24-21(15-9-3-6-12-18(15)27)25-23(26-22)17-11-5-8-14-20(17)29-2;1-27-17-12-13-18(19(26)14-17)22-24-20(15-8-4-2-5-9-15)23-21(25-22)16-10-6-3-7-11-16;1-27-17-13-11-16(12-14-17)21-23-20(15-7-3-2-4-8-15)24-22(25-21)18-9-5-6-10-19(18)26;25-18-14-8-7-13-17(18)20-22-19(15-9-3-1-4-10-15)23-21(24-20)26-16-11-5-2-6-12-16/h5-13,15-16,30H,1-3H3;3-14,27H,1-2H3;2*2-14,26H,1H3;1-14,25H
InChIKeySTGANZHIFOHCHJ-UHFFFAOYSA-N
XLogP23.43
TPSA368.34 Ų
H-Bond Donors5
H-Bond Acceptors28
Rotatable Bonds23
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001877.06
LogP ≤ 523.43
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol with MolForge

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Related Compounds

2-[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]-6-methoxyphenol;2-[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]-6-methylphenol;2-[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;5-methoxy-2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-(2-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol
CID 159572582
4-[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]benzene-1,3-diol;2-[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]-5-methoxyphenol;2-[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]-5-methylphenol;2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(2-methoxyphenyl)-6-(4-methoxyphenyl)-1,3,5-triazin-2-yl]phenol
CID 162105145
5-methoxy-2-[4-(4-methylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol
CID 143220402
4-[4-(2-hydroxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]-2,6-dimethoxyphenol
CID 143193670
2-[4-(2-methoxyphenyl)-6-(4-methylphenyl)-1,3,5-triazin-2-yl]phenol
CID 154527419
2-(4-anilino-6-phenyl-1,3,5-triazin-2-yl)-5-methoxyphenol
CID 136603035
4-[4-(2-hydroxy-4-methoxyphenyl)-6-(2-hydroxyphenyl)-1,3,5-triazin-2-yl]benzene-1,3-diol
CID 136946080
2-[4,6-bis(4-phenoxyphenyl)-1,3,5-triazin-2-yl]-5-methylphenol
CID 135621950
4-[4,6-bis(4-phenoxyphenyl)-1,3,5-triazin-2-yl]benzene-1,3-diol;2-[4,6-bis(4-phenoxyphenyl)-1,3,5-triazin-2-yl]-5-methylphenol
CID 136632194
2-[4-[4-(hydroxymethyl)phenyl]-6-(4-methoxyphenyl)-1,3,5-triazin-2-yl]phenol
CID 135597460
ethyl 4-[[4,6-bis(4-methoxyphenyl)-1,3,5-triazin-2-yl]amino]benzoate;methyl 4-[[4,6-bis(2-hydroxy-4-methoxyphenyl)-1,3,5-triazin-2-yl]amino]benzoate;2-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenol
CID 159906215
2-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenol;ethane
CID 136651088

Frequently Asked Questions

What is the IUPAC name of 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol?
The IUPAC name of 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol (CID 160930847) is 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol.
What is the SMILES notation for 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol?
The canonical SMILES for 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol is CC#COc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3O)n2)cc(OC)c1OC.COc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1.COc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3O)n2)cc1.COc1ccccc1-c1nc(-c2ccccc2O)nc(-c2ccccc2OC)n1.Oc1ccccc1-c1nc(Oc2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol?
The InChIKey is STGANZHIFOHCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N3O4.C23H19N3O3.2C22H17N3O2.C21H15N3O2/c1-4-14-33-22-16-18(15-21(31-2)23(22)32-3)25-27-24(17-10-6-5-7-11-17)28-26(29-25)19-12-8-9-13-20(19)30;1-28-19-13-7-4-10-16(19)22-24-21(15-9-3-6-12-18(15)27)25-23(26-22)17-11-5-8-14-20(17)29-2;1-27-17-12-13-18(19(26)14-17)22-24-20(15-8-4-2-5-9-15)23-21(25-22)16-10-6-3-7-11-16;1-27-17-13-11-16(12-14-17)21-23-20(15-7-3-2-4-8-15)24-22(25-21)18-9-5-6-10-19(18)26;25-18-14-8-7-13-17(18)20-22-19(15-9-3-1-4-10-15)23-21(24-20)26-16-11-5-2-6-12-16/h5-13,15-16,30H,1-3H3;3-14,27H,1-2H3;2*2-14,26H,1H3;1-14,25H.
What are the key properties of 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol?
2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol has a molecular weight of 1877.06 g/mol, XLogP of 23.43, 23 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,6-bis(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[4-(3,4-dimethoxy-5-prop-1-ynoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methoxyphenol;2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol;2-(4-phenoxy-6-phenyl-1,3,5-triazin-2-yl)phenol is sourced from PubChem (CID 160930847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).