2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine

C147H91N9O3S — CID 163963336

IUPAC2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4c5ccccc5c(-c5ccccc5)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccccc4-c4ccccc4)c3)nc(-c3c4ccccc4c(-c4ccccc4)c4oc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5ccc(-c6c7ccccc7c(-c7ccccc7)c7sc8ccccc8c67)cc5c34)n2)cc1
InChIInChI=1S/C49H29N3OS.2C49H31N3O/c1-4-15-30(16-5-1)43-35-22-11-10-21-34(35)42(45-36-23-12-13-26-41(36)54-46(43)45)33-27-28-39-38(29-33)44-37(24-14-25-40(44)53-39)49-51-47(31-17-6-2-7-18-31)50-48(52-49)32-19-8-3-9-20-32;1-4-17-32(18-5-1)35-23-16-24-36(31-35)37-25-10-13-28-40(37)48-50-47(34-21-8-3-9-22-34)51-49(52-48)45-39-27-12-11-26-38(39)43(33-19-6-2-7-20-33)46-44(45)41-29-14-15-30-42(41)53-46;1-4-17-32(18-5-1)37-25-10-11-26-38(37)35-23-16-24-36(31-35)48-50-47(34-21-8-3-9-22-34)51-49(52-48)45-40-28-13-12-27-39(40)43(33-19-6-2-7-20-33)46-44(45)41-29-14-15-30-42(41)53-46/h1-29H;2*1-31H
InChIKeySJLFKOUNNGNEOL-UHFFFAOYSA-N
MW2063.47 g/mol
LogP39.48
Rot. Bonds17

About 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine

2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine (PubChem CID 163963336) has the molecular formula C147H91N9O3S and a molecular weight of 2063.47 g/mol. Its IUPAC name is 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine
PubChem CID163963336
Molecular FormulaC147H91N9O3S
Molecular Weight2063.47 g/mol
Exact Mass2061.70
IUPAC Name2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4c5ccccc5c(-c5ccccc5)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccccc4-c4ccccc4)c3)nc(-c3c4ccccc4c(-c4ccccc4)c4oc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5ccc(-c6c7ccccc7c(-c7ccccc7)c7sc8ccccc8c67)cc5c34)n2)cc1
InChIInChI=1S/C49H29N3OS.2C49H31N3O/c1-4-15-30(16-5-1)43-35-22-11-10-21-34(35)42(45-36-23-12-13-26-41(36)54-46(43)45)33-27-28-39-38(29-33)44-37(24-14-25-40(44)53-39)49-51-47(31-17-6-2-7-18-31)50-48(52-49)32-19-8-3-9-20-32;1-4-17-32(18-5-1)35-23-16-24-36(31-35)37-25-10-13-28-40(37)48-50-47(34-21-8-3-9-22-34)51-49(52-48)45-39-27-12-11-26-38(39)43(33-19-6-2-7-20-33)46-44(45)41-29-14-15-30-42(41)53-46;1-4-17-32(18-5-1)37-25-10-11-26-38(37)35-23-16-24-36(31-35)48-50-47(34-21-8-3-9-22-34)51-49(52-48)45-40-28-13-12-27-39(40)43(33-19-6-2-7-20-33)46-44(45)41-29-14-15-30-42(41)53-46/h1-29H;2*1-31H
InChIKeySJLFKOUNNGNEOL-UHFFFAOYSA-N
XLogP39.48
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds17
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002063.47
LogP ≤ 539.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine with MolForge

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Related Compounds

2-phenanthren-1-yl-4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)-6-[2-(4-phenylphenyl)phenyl]-1,3,5-triazine;4-phenyl-2-[6-(3-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-[1]benzothiolo[3,2-d]pyrimidine
CID 163725404
2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 162712574
2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine
CID 163618006
2-dibenzothiophen-1-yl-4-phenyl-6-[3-[8-(2-phenylphenyl)dibenzofuran-1-yl]phenyl]-1,3,5-triazine
CID 134198900
2-[2-(3-dibenzothiophen-4-ylphenyl)-5-phenylphenyl]-4-phenyl-6-(8-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 139549065
2-dibenzofuran-1-yl-4-[4-[3-[6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]dibenzothiophen-2-yl]phenyl]phenyl]-6-[4-(8-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine
CID 155329850
2-(8-dibenzofuran-1-yldibenzofuran-1-yl)-4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazine
CID 166742090
2-dibenzofuran-4-yl-4-[4-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-8-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzothiophen-3-yl-4-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-6-phenyl-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4,6,8,12,14,16,18-nonaen-5-yl)-6-phenyl-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-6-phenyl-1,3,5-triazine;2,4-di(dibenzothiophen-4-yl)-6-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-1,3,5-triazine;2-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 165006268
2-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine;2-(8-phenyldibenzofuran-1-yl)-4-(4-phenylphenyl)-6-[3-phenyl-5-(6-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(8-phenyldibenzofuran-1-yl)-6-[3-(6-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine
CID 161063143
2-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-6-[2-(8-phenyldibenzofuran-1-yl)phenyl]-1,3,5-triazine
CID 140946239
2-(3-dibenzofuran-4-ylphenyl)-4-phenyl-6-[8-(3-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[8-[3-phenyl-5-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[8-[2-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[8-[4-[3-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-yl]-1,3,5-triazine
CID 158497651
2-dibenzothiophen-1-yl-4-phenyl-6-[3-[8-(2-phenylphenyl)dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2-dibenzothiophen-2-yl-4-phenyl-6-[4-[8-(4-phenylphenyl)dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2-dibenzothiophen-3-yl-4-phenyl-6-[8-(3-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine
CID 161021591

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine (CID 163963336) is 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine is c1ccc(-c2cccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4c5ccccc5c(-c5ccccc5)c5oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccccc4-c4ccccc4)c3)nc(-c3c4ccccc4c(-c4ccccc4)c4oc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5ccc(-c6c7ccccc7c(-c7ccccc7)c7sc8ccccc8c67)cc5c34)n2)cc1.
What is the InChIKey of 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine?
The InChIKey is SJLFKOUNNGNEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H29N3OS.2C49H31N3O/c1-4-15-30(16-5-1)43-35-22-11-10-21-34(35)42(45-36-23-12-13-26-41(36)54-46(43)45)33-27-28-39-38(29-33)44-37(24-14-25-40(44)53-39)49-51-47(31-17-6-2-7-18-31)50-48(52-49)32-19-8-3-9-20-32;1-4-17-32(18-5-1)35-23-16-24-36(31-35)37-25-10-13-28-40(37)48-50-47(34-21-8-3-9-22-34)51-49(52-48)45-39-27-12-11-26-38(39)43(33-19-6-2-7-20-33)46-44(45)41-29-14-15-30-42(41)53-46;1-4-17-32(18-5-1)37-25-10-11-26-38(37)35-23-16-24-36(31-35)48-50-47(34-21-8-3-9-22-34)51-49(52-48)45-40-28-13-12-27-39(40)43(33-19-6-2-7-20-33)46-44(45)41-29-14-15-30-42(41)53-46/h1-29H;2*1-31H.
What are the key properties of 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine?
2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine has a molecular weight of 2063.47 g/mol, XLogP of 39.48, 17 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[8-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazine is sourced from PubChem (CID 163963336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).