8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline

C108H74N8O2 — CID 163460308

IUPAC8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline
SMILESC1=CC(c2ccc3c(c2)Oc2ccccc2C32c3ccc(C4=NC(c5ccc(-c6ccccc6)cc5)=NC(c5ccccc5)N4)cc3-c3cc(-c4cccc5c4N=CCC5)ccc32)CC(C2NC(c3ccc4c(c3)-c3cc(-c5cccc6cccnc56)ccc3C43c4ccccc4Oc4ccccc43)=NC(c3cccc4ccccc34)N2)=C1
InChIInChI=1S/C108H74N8O2/c1-3-21-65(22-4-1)66-43-45-71(46-44-66)102-111-101(70-24-5-2-6-25-70)112-104(113-102)77-50-55-90-86(62-77)84-61-75(81-35-18-28-69-32-20-58-110-100(69)81)49-53-88(84)108(90)93-39-11-14-42-97(93)118-98-64-73(47-56-94(98)108)72-29-15-30-76(59-72)103-114-105(116-106(115-103)82-36-16-26-67-23-7-8-33-79(67)82)78-51-54-89-85(63-78)83-60-74(80-34-17-27-68-31-19-57-109-99(68)80)48-52-87(83)107(89)91-37-9-12-40-95(91)117-96-41-13-10-38-92(96)107/h1-19,21-31,33-58,60-64,72,101,103,106,115H,20,32,59H2,(H,114,116)(H,111,112,113)
InChIKeyBNZYHTGFFWAWNC-UHFFFAOYSA-N
MW1515.83 g/mol
LogP24.10
Rot. Bonds10

About 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline

8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline (PubChem CID 163460308) has the molecular formula C108H74N8O2 and a molecular weight of 1515.83 g/mol. Its IUPAC name is 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline.

Molecular Properties

Compound Name8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline
PubChem CID163460308
Molecular FormulaC108H74N8O2
Molecular Weight1515.83 g/mol
Exact Mass1514.59
IUPAC Name8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline
SMILESC1=CC(c2ccc3c(c2)Oc2ccccc2C32c3ccc(C4=NC(c5ccc(-c6ccccc6)cc5)=NC(c5ccccc5)N4)cc3-c3cc(-c4cccc5c4N=CCC5)ccc32)CC(C2NC(c3ccc4c(c3)-c3cc(-c5cccc6cccnc56)ccc3C43c4ccccc4Oc4ccccc43)=NC(c3cccc4ccccc34)N2)=C1
InChIInChI=1S/C108H74N8O2/c1-3-21-65(22-4-1)66-43-45-71(46-44-66)102-111-101(70-24-5-2-6-25-70)112-104(113-102)77-50-55-90-86(62-77)84-61-75(81-35-18-28-69-32-20-58-110-100(69)81)49-53-88(84)108(90)93-39-11-14-42-97(93)118-98-64-73(47-56-94(98)108)72-29-15-30-76(59-72)103-114-105(116-106(115-103)82-36-16-26-67-23-7-8-33-79(67)82)78-51-54-89-85(63-78)83-60-74(80-34-17-27-68-31-19-57-109-99(68)80)48-52-87(83)107(89)91-37-9-12-40-95(91)117-96-41-13-10-38-92(96)107/h1-19,21-31,33-58,60-64,72,101,103,106,115H,20,32,59H2,(H,114,116)(H,111,112,113)
InChIKeyBNZYHTGFFWAWNC-UHFFFAOYSA-N
XLogP24.10
TPSA116.88 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds10
Heavy Atoms118
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001515.83
LogP ≤ 524.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline with MolForge

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Related Compounds

2,4-diphenyl-6-(6-spiro[fluorene-9,9'-xanthene]-2'-yldibenzofuran-4-yl)-1,2-dihydro-1,3,5-triazine
CID 146322030
4-phenyl-2-(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-4-yl-1,2,3,4-tetrahydro-1,3,5-triazine
CID 146321879
8-[7-[4-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)phenyl]spiro[fluorene-9,9'-xanthene]-2-yl]isoquinoline
CID 163570159
6-[3-(9,9-diphenylfluoren-3-yl)phenyl]-2-phenyl-4-triphenylen-2-yl-1,2-dihydro-1,3,5-triazine
CID 174243644
8-[6-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline;8-[6-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,9'-xanthene]-3-yl]quinoline;8-[6-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline
CID 164954461
8-[4-[6-(4,6-diphenylpyrimidin-2-yl)spiro[fluorene-9,9'-xanthene]-3-yl]phenyl]quinoline
CID 146547263
6-[4-[2-(9,9-diphenylfluoren-2-yl)naphthalen-1-yl]phenyl]-2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazine
CID 145415039
12,12-dimethyl-5-[6-phenyl-4-(4-phenylphenyl)-1,2,3,4-tetrahydro-1,3,5-triazin-2-yl]-11-spiro[fluorene-9,9'-xanthene]-2-ylindeno[2,1-a]carbazole
CID 146321981
8-[6'-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-3'-yl]quinoline
CID 164793250
8-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl)phenyl]quinoline
CID 137388424
9-[3-[2-phenyl-6-(6-spiro[fluorene-9,9'-xanthene]-2'-yldibenzofuran-4-yl)-1,2-dihydro-1,3,5-triazin-4-yl]phenyl]carbazole
CID 146322027
2,4,6-tri(spiro[fluorene-9,9'-xanthene]-2'-yl)-1,2,3,4-tetrahydro-1,3,5-triazine
CID 147530419

Frequently Asked Questions

What is the IUPAC name of 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline?
The IUPAC name of 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline (CID 163460308) is 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline.
What is the SMILES notation for 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline?
The canonical SMILES for 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline is C1=CC(c2ccc3c(c2)Oc2ccccc2C32c3ccc(C4=NC(c5ccc(-c6ccccc6)cc5)=NC(c5ccccc5)N4)cc3-c3cc(-c4cccc5c4N=CCC5)ccc32)CC(C2NC(c3ccc4c(c3)-c3cc(-c5cccc6cccnc56)ccc3C43c4ccccc4Oc4ccccc43)=NC(c3cccc4ccccc34)N2)=C1.
What is the InChIKey of 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline?
The InChIKey is BNZYHTGFFWAWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H74N8O2/c1-3-21-65(22-4-1)66-43-45-71(46-44-66)102-111-101(70-24-5-2-6-25-70)112-104(113-102)77-50-55-90-86(62-77)84-61-75(81-35-18-28-69-32-20-58-110-100(69)81)49-53-88(84)108(90)93-39-11-14-42-97(93)118-98-64-73(47-56-94(98)108)72-29-15-30-76(59-72)103-114-105(116-106(115-103)82-36-16-26-67-23-7-8-33-79(67)82)78-51-54-89-85(63-78)83-60-74(80-34-17-27-68-31-19-57-109-99(68)80)48-52-87(83)107(89)91-37-9-12-40-95(91)117-96-41-13-10-38-92(96)107/h1-19,21-31,33-58,60-64,72,101,103,106,115H,20,32,59H2,(H,114,116)(H,111,112,113).
What are the key properties of 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline?
8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline has a molecular weight of 1515.83 g/mol, XLogP of 24.10, 10 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-[2-[5-[3-(3,4-dihydroquinolin-8-yl)-6-[2-phenyl-4-(4-phenylphenyl)-1,2-dihydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3'-yl]cyclohexa-1,3-dien-1-yl]-4-naphthalen-1-yl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]spiro[fluorene-9,9'-xanthene]-3-yl]quinoline is sourced from PubChem (CID 163460308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).