4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine

C157H96N6O3 — CID 146343206

IUPAC4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine
SMILESc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5Oc5ccccc5C65c6ccccc6-c6ccccc65)cc4)n3)cc(-c3cccc4c3-c3ccccc3C43c4ccccc4Oc4c(-c5ccc(-c6nc(-c7ccccc7)cc(-c7ccccc7-c7cccc(-c8cccc9c8-c8ccccc8C98c9ccccc9Oc9c(-c%10ccc(-c%11nc(-c%12ccccc%12)cc(-c%12ccc%13ccccc%13c%12)n%11)cc%10)cccc98)c7)n6)cc5)cccc43)c2)cc1
InChIInChI=1S/C157H96N6O3/c1-5-37-97(38-6-1)112-91-113(93-114(92-112)142-95-139(103-42-9-3-10-43-103)159-153(162-142)106-84-78-99(79-85-106)118-57-34-69-135-149(118)164-144-72-28-25-64-130(144)155(135)126-60-21-17-50-121(126)122-51-18-22-61-127(122)155)117-56-33-68-134-148(117)125-54-20-24-63-129(125)157(134)132-66-27-30-74-146(132)166-151-120(59-36-71-137(151)157)101-80-86-107(87-81-101)154-160-140(104-44-11-4-12-45-104)96-143(163-154)123-52-16-15-49-115(123)109-47-31-48-110(90-109)116-55-32-67-133-147(116)124-53-19-23-62-128(124)156(133)131-65-26-29-73-145(131)165-150-119(58-35-70-136(150)156)100-76-82-105(83-77-100)152-158-138(102-40-7-2-8-41-102)94-141(161-152)111-88-75-98-39-13-14-46-108(98)89-111/h1-96H
InChIKeyXLCZZUDLQGNRLC-UHFFFAOYSA-N
MW2114.53 g/mol
LogP39.29
Rot. Bonds16

About 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine

4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine (PubChem CID 146343206) has the molecular formula C157H96N6O3 and a molecular weight of 2114.53 g/mol. Its IUPAC name is 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine.

Molecular Properties

Compound Name4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine
PubChem CID146343206
Molecular FormulaC157H96N6O3
Molecular Weight2114.53 g/mol
Exact Mass2112.75
IUPAC Name4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine
SMILESc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5Oc5ccccc5C65c6ccccc6-c6ccccc65)cc4)n3)cc(-c3cccc4c3-c3ccccc3C43c4ccccc4Oc4c(-c5ccc(-c6nc(-c7ccccc7)cc(-c7ccccc7-c7cccc(-c8cccc9c8-c8ccccc8C98c9ccccc9Oc9c(-c%10ccc(-c%11nc(-c%12ccccc%12)cc(-c%12ccc%13ccccc%13c%12)n%11)cc%10)cccc98)c7)n6)cc5)cccc43)c2)cc1
InChIInChI=1S/C157H96N6O3/c1-5-37-97(38-6-1)112-91-113(93-114(92-112)142-95-139(103-42-9-3-10-43-103)159-153(162-142)106-84-78-99(79-85-106)118-57-34-69-135-149(118)164-144-72-28-25-64-130(144)155(135)126-60-21-17-50-121(126)122-51-18-22-61-127(122)155)117-56-33-68-134-148(117)125-54-20-24-63-129(125)157(134)132-66-27-30-74-146(132)166-151-120(59-36-71-137(151)157)101-80-86-107(87-81-101)154-160-140(104-44-11-4-12-45-104)96-143(163-154)123-52-16-15-49-115(123)109-47-31-48-110(90-109)116-55-32-67-133-147(116)124-53-19-23-62-128(124)156(133)131-65-26-29-73-145(131)165-150-119(58-35-70-136(150)156)100-76-82-105(83-77-100)152-158-138(102-40-7-2-8-41-102)94-141(161-152)111-88-75-98-39-13-14-46-108(98)89-111/h1-96H
InChIKeyXLCZZUDLQGNRLC-UHFFFAOYSA-N
XLogP39.29
TPSA105.03 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds16
Heavy Atoms166
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002114.53
LogP ≤ 539.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine with MolForge

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Related Compounds

4,6-bis(4-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-4'-ylpyrimidine;4-naphthalen-2-yl-6-phenyl-2-spiro[fluorene-9,9'-xanthene]-4'-ylpyrimidine;4-phenyl-6-(2-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-4'-ylpyrimidine;4-phenyl-6-(3-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-4'-ylpyrimidine
CID 158575823
4-naphthalen-2-yl-2-phenyl-6-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidine
CID 140947149
4-naphthalen-2-yl-2-(3-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-4'-ylpyridine;4-naphthalen-2-yl-2-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-ylpyrimidine;2-phenyl-4-(3-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3-ylpyrimidine;2-phenyl-4-(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-4-ylpyrimidine
CID 159959873
4-naphthalen-2-yl-6-phenyl-2-[2-[4-[3-[4-[6-phenyl-2-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]pyrimidine
CID 137388695
4,6-bis(4-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-3'-ylpyrimidine;4,6-diphenyl-2-spiro[fluorene-9,9'-xanthene]-3'-ylpyrimidine;4-naphthalen-2-yl-6-phenyl-2-spiro[fluorene-9,9'-xanthene]-3'-ylpyrimidine;4-phenyl-6-(2-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-3'-ylpyrimidine;4-phenyl-6-(3-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-3'-ylpyrimidine;4-phenyl-6-(4-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-3'-ylpyrimidine
CID 159580359
2,4-diphenyl-6-[4-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)phenyl]pyrimidine
CID 137388381
4,6-diphenyl-2-[2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)phenyl]pyrimidine;4,6-diphenyl-2-[4-(2-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)phenyl]pyrimidine;4-phenyl-6-(3-phenylphenyl)-2-[3-(3-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)phenyl]pyrimidine;4-phenyl-6-(4-phenylphenyl)-2-[3-(3-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)phenyl]pyrimidine
CID 158213395
4,6-bis(4-phenylphenyl)-2-(3-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidine
CID 140947301
4-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]benzonitrile;4-[4-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]benzonitrile;4-[4-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]spiro[fluorene-9,9'-xanthene]-4'-yl]benzonitrile
CID 160882389
2,4-bis(4-phenylphenyl)-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)pyrimidine;2,4-diphenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)pyrimidine
CID 159156197
4-(4-naphthalen-2-ylphenyl)-6-phenyl-2-spiro[fluorene-9,9'-xanthene]-4-ylpyrimidine
CID 158505780
2,4-bis(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-4'-ylpyrimidine
CID 140947259

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine?
The IUPAC name of 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine (CID 146343206) is 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine.
What is the SMILES notation for 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine?
The canonical SMILES for 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine is c1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5Oc5ccccc5C65c6ccccc6-c6ccccc65)cc4)n3)cc(-c3cccc4c3-c3ccccc3C43c4ccccc4Oc4c(-c5ccc(-c6nc(-c7ccccc7)cc(-c7ccccc7-c7cccc(-c8cccc9c8-c8ccccc8C98c9ccccc9Oc9c(-c%10ccc(-c%11nc(-c%12ccccc%12)cc(-c%12ccc%13ccccc%13c%12)n%11)cc%10)cccc98)c7)n6)cc5)cccc43)c2)cc1.
What is the InChIKey of 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine?
The InChIKey is XLCZZUDLQGNRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C157H96N6O3/c1-5-37-97(38-6-1)112-91-113(93-114(92-112)142-95-139(103-42-9-3-10-43-103)159-153(162-142)106-84-78-99(79-85-106)118-57-34-69-135-149(118)164-144-72-28-25-64-130(144)155(135)126-60-21-17-50-121(126)122-51-18-22-61-127(122)155)117-56-33-68-134-148(117)125-54-20-24-63-129(125)157(134)132-66-27-30-74-146(132)166-151-120(59-36-71-137(151)157)101-80-86-107(87-81-101)154-160-140(104-44-11-4-12-45-104)96-143(163-154)123-52-16-15-49-115(123)109-47-31-48-110(90-109)116-55-32-67-133-147(116)124-53-19-23-62-128(124)156(133)131-65-26-29-73-145(131)165-150-119(58-35-70-136(150)156)100-76-82-105(83-77-100)152-158-138(102-40-7-2-8-41-102)94-141(161-152)111-88-75-98-39-13-14-46-108(98)89-111/h1-96H.
What are the key properties of 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine?
4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine has a molecular weight of 2114.53 g/mol, XLogP of 39.29, 16 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-2-yl-6-phenyl-2-[4-[4-[3-[2-[6-phenyl-2-[4-[4-[3-phenyl-5-[6-phenyl-2-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)pyrimidin-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidin-4-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]pyrimidine is sourced from PubChem (CID 146343206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).