2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine

C135H83N9O3 — CID 164965307

IUPAC2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4cc5ccccc5c5ccc(-c6ccccc6)cc45)nc(-c4cccc5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)c(-c4ccccc4)cc4ccccc45)nc(-c4cccc5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)ccc43)c2)cc1
InChIInChI=1S/2C47H29N3O.C41H25N3O/c1-3-12-30(13-4-1)31-22-24-33(25-23-31)45-48-46(50-47(49-45)39-19-11-21-43-44(39)38-18-9-10-20-42(38)51-43)35-26-27-37-36-17-8-7-16-34(36)28-40(41(37)29-35)32-14-5-2-6-15-32;1-3-12-30(13-4-1)32-22-24-33(25-23-32)45-48-46(39-19-11-21-43-44(39)38-18-9-10-20-42(38)51-43)50-47(49-45)41-29-35-16-7-8-17-36(35)37-27-26-34(28-40(37)41)31-14-5-2-6-15-31;1-3-10-26(11-4-1)28-20-22-32-29(24-28)18-19-30-25-31(21-23-33(30)32)40-42-39(27-12-5-2-6-13-27)43-41(44-40)35-15-9-17-37-38(35)34-14-7-8-16-36(34)45-37/h2*1-29H;1-25H
InChIKeyCKCLLNVXZMVBQR-UHFFFAOYSA-N
MW1879.21 g/mol
LogP35.57
Rot. Bonds14

About 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine

2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine (PubChem CID 164965307) has the molecular formula C135H83N9O3 and a molecular weight of 1879.21 g/mol. Its IUPAC name is 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine
PubChem CID164965307
Molecular FormulaC135H83N9O3
Molecular Weight1879.21 g/mol
Exact Mass1877.66
IUPAC Name2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4cc5ccccc5c5ccc(-c6ccccc6)cc45)nc(-c4cccc5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)c(-c4ccccc4)cc4ccccc45)nc(-c4cccc5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)ccc43)c2)cc1
InChIInChI=1S/2C47H29N3O.C41H25N3O/c1-3-12-30(13-4-1)31-22-24-33(25-23-31)45-48-46(50-47(49-45)39-19-11-21-43-44(39)38-18-9-10-20-42(38)51-43)35-26-27-37-36-17-8-7-16-34(36)28-40(41(37)29-35)32-14-5-2-6-15-32;1-3-12-30(13-4-1)32-22-24-33(25-23-32)45-48-46(39-19-11-21-43-44(39)38-18-9-10-20-42(38)51-43)50-47(49-45)41-29-35-16-7-8-17-36(35)37-27-26-34(28-40(37)41)31-14-5-2-6-15-31;1-3-10-26(11-4-1)28-20-22-32-29(24-28)18-19-30-25-31(21-23-33(30)32)40-42-39(27-12-5-2-6-13-27)43-41(44-40)35-15-9-17-37-38(35)34-14-7-8-16-36(34)45-37/h2*1-29H;1-25H
InChIKeyCKCLLNVXZMVBQR-UHFFFAOYSA-N
XLogP35.57
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds14
Heavy Atoms147
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001879.21
LogP ≤ 535.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine with MolForge

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Related Compounds

2-dibenzofuran-1-yl-4-(10-phenylphenanthren-3-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 174314611
2-dibenzofuran-1-yl-4-phenyl-6-(2-phenylphenanthren-9-yl)-1,3,5-triazine
CID 171607680
2,4-di(dibenzofuran-1-yl)-6-[3-(10-phenylphenanthren-3-yl)phenyl]-1,3,5-triazine
CID 174314994
2-naphthalen-2-yl-4-phenanthren-9-yl-6-(8-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 166742551
2-dibenzofuran-1-yl-4-[3-(4-naphthalen-2-ylphenyl)phenyl]-6-phenanthren-9-yl-1,3,5-triazine
CID 169053906
2-dibenzofuran-1-yl-4-phenanthren-2-yl-6-(4-phenylphenyl)-1,3,5-triazine;hydride
CID 164955925
2-dibenzofuran-1-yl-4-phenyl-6-[4-(6-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazine
CID 171607685
2-(8-phenanthren-2-yldibenzofuran-1-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 142353054
2-naphtho[3,2-b][1]benzofuran-8-yl-4-phenanthren-9-yl-6-(7-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 174198668
2-dibenzofuran-1-yl-4-phenyl-6-[5-(6-phenylnaphthalen-1-yl)naphthalen-1-yl]-1,3,5-triazine
CID 176766233
2-(7-phenanthren-2-yldibenzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 166741783
2-benzo[c]phenanthren-2-yl-4-dibenzofuran-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-(2-chrysen-3-ylphenyl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(2-chrysen-3-ylphenyl)-4-naphthalen-2-yl-6-phenanthren-9-yl-1,3,5-triazine;2-chrysen-3-yl-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 158853563

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine?
The IUPAC name of 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine (CID 164965307) is 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine?
The canonical SMILES for 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4cc5ccccc5c5ccc(-c6ccccc6)cc45)nc(-c4cccc5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)c(-c4ccccc4)cc4ccccc45)nc(-c4cccc5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)ccc43)c2)cc1.
What is the InChIKey of 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine?
The InChIKey is CKCLLNVXZMVBQR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C47H29N3O.C41H25N3O/c1-3-12-30(13-4-1)31-22-24-33(25-23-31)45-48-46(50-47(49-45)39-19-11-21-43-44(39)38-18-9-10-20-42(38)51-43)35-26-27-37-36-17-8-7-16-34(36)28-40(41(37)29-35)32-14-5-2-6-15-32;1-3-12-30(13-4-1)32-22-24-33(25-23-32)45-48-46(39-19-11-21-43-44(39)38-18-9-10-20-42(38)51-43)50-47(49-45)41-29-35-16-7-8-17-36(35)37-27-26-34(28-40(37)41)31-14-5-2-6-15-31;1-3-10-26(11-4-1)28-20-22-32-29(24-28)18-19-30-25-31(21-23-33(30)32)40-42-39(27-12-5-2-6-13-27)43-41(44-40)35-15-9-17-37-38(35)34-14-7-8-16-36(34)45-37/h2*1-29H;1-25H.
What are the key properties of 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine?
2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine has a molecular weight of 1879.21 g/mol, XLogP of 35.57, 14 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-1-yl-4-(7-phenylphenanthren-9-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-(10-phenylphenanthren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-1-yl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine is sourced from PubChem (CID 164965307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).