10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine

C101H60N8O3 — CID 146343181

IUPAC10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine
SMILESc1cc(-c2nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(-c7cccc8cccnc78)cc6)nc(-c6ccc7c(c6)Oc6ccccc6C76c7ccccc7-c7ccccc76)n5)cc4)cc3)nc(-c3ccc4c(c3)Oc3ccccc3C43c4ccccc4-c4ccccc43)n2)cc(N2c3ccccc3Oc3ccccc32)c1
InChIInChI=1S/C101H60N8O3/c1-5-29-77-73(24-1)74-25-2-6-30-78(74)100(77)81-33-9-13-37-87(81)110-91-59-69(53-55-83(91)100)98-105-94(103-95(106-98)67-51-45-63(46-52-67)72-28-18-20-64-22-19-57-102-93(64)72)65-47-41-61(42-48-65)62-43-49-66(50-44-62)96-104-97(68-21-17-23-71(58-68)109-85-35-11-15-39-89(85)112-90-40-16-12-36-86(90)109)108-99(107-96)70-54-56-84-92(60-70)111-88-38-14-10-34-82(88)101(84)79-31-7-3-26-75(79)76-27-4-8-32-80(76)101/h1-60H
InChIKeyKRPISXNDKCFKTL-UHFFFAOYSA-N
MW1433.64 g/mol
LogP24.45
Rot. Bonds9

About 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine

10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine (PubChem CID 146343181) has the molecular formula C101H60N8O3 and a molecular weight of 1433.64 g/mol. Its IUPAC name is 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine.

Molecular Properties

Compound Name10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine
PubChem CID146343181
Molecular FormulaC101H60N8O3
Molecular Weight1433.64 g/mol
Exact Mass1432.48
IUPAC Name10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine
SMILESc1cc(-c2nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(-c7cccc8cccnc78)cc6)nc(-c6ccc7c(c6)Oc6ccccc6C76c7ccccc7-c7ccccc76)n5)cc4)cc3)nc(-c3ccc4c(c3)Oc3ccccc3C43c4ccccc4-c4ccccc43)n2)cc(N2c3ccccc3Oc3ccccc32)c1
InChIInChI=1S/C101H60N8O3/c1-5-29-77-73(24-1)74-25-2-6-30-78(74)100(77)81-33-9-13-37-87(81)110-91-59-69(53-55-83(91)100)98-105-94(103-95(106-98)67-51-45-63(46-52-67)72-28-18-20-64-22-19-57-102-93(64)72)65-47-41-61(42-48-65)62-43-49-66(50-44-62)96-104-97(68-21-17-23-71(58-68)109-85-35-11-15-39-89(85)112-90-40-16-12-36-86(90)109)108-99(107-96)70-54-56-84-92(60-70)111-88-38-14-10-34-82(88)101(84)79-31-7-3-26-75(79)76-27-4-8-32-80(76)101/h1-60H
InChIKeyKRPISXNDKCFKTL-UHFFFAOYSA-N
XLogP24.45
TPSA121.16 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds9
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001433.64
LogP ≤ 524.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine?
The IUPAC name of 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine (CID 146343181) is 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine.
What is the SMILES notation for 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine?
The canonical SMILES for 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine is c1cc(-c2nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(-c7cccc8cccnc78)cc6)nc(-c6ccc7c(c6)Oc6ccccc6C76c7ccccc7-c7ccccc76)n5)cc4)cc3)nc(-c3ccc4c(c3)Oc3ccccc3C43c4ccccc4-c4ccccc43)n2)cc(N2c3ccccc3Oc3ccccc32)c1.
What is the InChIKey of 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine?
The InChIKey is KRPISXNDKCFKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C101H60N8O3/c1-5-29-77-73(24-1)74-25-2-6-30-78(74)100(77)81-33-9-13-37-87(81)110-91-59-69(53-55-83(91)100)98-105-94(103-95(106-98)67-51-45-63(46-52-67)72-28-18-20-64-22-19-57-102-93(64)72)65-47-41-61(42-48-65)62-43-49-66(50-44-62)96-104-97(68-21-17-23-71(58-68)109-85-35-11-15-39-89(85)112-90-40-16-12-36-86(90)109)108-99(107-96)70-54-56-84-92(60-70)111-88-38-14-10-34-82(88)101(84)79-31-7-3-26-75(79)76-27-4-8-32-80(76)101/h1-60H.
What are the key properties of 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine?
10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine has a molecular weight of 1433.64 g/mol, XLogP of 24.45, 9 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-[4-[4-[4-[4-(4-quinolin-8-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl]phenyl]phenoxazine is sourced from PubChem (CID 146343181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).