5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline

C159H102N12O3 — CID 165102916

IUPAC5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline
SMILESC1=CC2C(Oc3c(-c4ccc(-c5cccc6ncccc56)cc4)cccc3C23c2ccccc2-c2ccccc23)C(C2=NC(c3ccccc3)N=C(c3ccccc3)N2)=C1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3c(-c5ccc(-c6ccnc7ccccc67)cc5)cccc3C43c4ccccc4-c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3c(-c5cccc6cnccc56)cccc3C43c4ccccc4-c4ccccc43)n2)cc1
InChIInChI=1S/C55H34N4O.C55H38N4O.C49H30N4O/c1-3-15-37(16-4-1)52-57-53(38-17-5-2-6-18-38)59-54(58-52)44-23-14-27-48-51(44)60-50-40(36-31-29-35(30-32-36)39-33-34-56-49-28-12-9-21-43(39)49)22-13-26-47(50)55(48)45-24-10-7-19-41(45)42-20-8-11-25-46(42)55;1-3-15-37(16-4-1)52-57-53(38-17-5-2-6-18-38)59-54(58-52)44-23-12-28-48-51(44)60-50-40(36-32-30-35(31-33-36)39-21-13-29-49-43(39)24-14-34-56-49)22-11-27-47(50)55(48)45-25-9-7-19-41(45)42-20-8-10-26-46(42)55;1-3-14-31(15-4-1)46-51-47(32-16-5-2-6-17-32)53-48(52-46)39-23-13-27-43-45(39)54-44-38(35-21-11-18-33-30-50-29-28-34(33)35)22-12-26-42(44)49(43)40-24-9-7-19-36(40)37-20-8-10-25-41(37)49/h1-34H;1-34,48,51-52H,(H,57,58,59);1-30H
InChIKeyYQFSXWHTWOMPRD-UHFFFAOYSA-N
MW2228.65 g/mol
LogP36.68
Rot. Bonds14

About 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline

5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline (PubChem CID 165102916) has the molecular formula C159H102N12O3 and a molecular weight of 2228.65 g/mol. Its IUPAC name is 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline.

Molecular Properties

Compound Name5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline
PubChem CID165102916
Molecular FormulaC159H102N12O3
Molecular Weight2228.65 g/mol
Exact Mass2226.82
IUPAC Name5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline
SMILESC1=CC2C(Oc3c(-c4ccc(-c5cccc6ncccc56)cc4)cccc3C23c2ccccc2-c2ccccc23)C(C2=NC(c3ccccc3)N=C(c3ccccc3)N2)=C1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3c(-c5ccc(-c6ccnc7ccccc67)cc5)cccc3C43c4ccccc4-c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3c(-c5cccc6cnccc56)cccc3C43c4ccccc4-c4ccccc43)n2)cc1
InChIInChI=1S/C55H34N4O.C55H38N4O.C49H30N4O/c1-3-15-37(16-4-1)52-57-53(38-17-5-2-6-18-38)59-54(58-52)44-23-14-27-48-51(44)60-50-40(36-31-29-35(30-32-36)39-33-34-56-49-28-12-9-21-43(39)49)22-13-26-47(50)55(48)45-24-10-7-19-41(45)42-20-8-11-25-46(42)55;1-3-15-37(16-4-1)52-57-53(38-17-5-2-6-18-38)59-54(58-52)44-23-12-28-48-51(44)60-50-40(36-32-30-35(31-33-36)39-21-13-29-49-43(39)24-14-34-56-49)22-11-27-47(50)55(48)45-25-9-7-19-41(45)42-20-8-10-26-46(42)55;1-3-14-31(15-4-1)46-51-47(32-16-5-2-6-17-32)53-48(52-46)39-23-13-27-43-45(39)54-44-38(35-21-11-18-33-30-50-29-28-34(33)35)22-12-26-42(44)49(43)40-24-9-7-19-36(40)37-20-8-10-25-41(37)49/h1-34H;1-34,48,51-52H,(H,57,58,59);1-30H
InChIKeyYQFSXWHTWOMPRD-UHFFFAOYSA-N
XLogP36.68
TPSA180.45 Ų
H-Bond Donors1
H-Bond Acceptors15
Rotatable Bonds14
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002228.65
LogP ≤ 536.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1015

Analyze 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-[5'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline
CID 146547151
8-[5'-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]quinoline;8-[5'-(4,6-diphenylpyrimidin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]-4-phenylquinoline;8-[5'-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]spiro[fluorene-9,9'-xanthene]-4'-yl]-4a,8a-dihydroquinoline
CID 164981172
5-[5'-[6-phenyl-2-[4-(4-phenylphenyl)phenyl]pyrimidin-4-yl]spiro[fluorene-9,9'-xanthene]-4'-yl]quinoline
CID 146547267
8-[5'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]quinoline
CID 146547205
8-[5'-[4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]spiro[fluorene-9,9'-xanthene]-4'-yl]quinoline
CID 146547203
5-[4-[(9R)-7'-(2,6-diphenylpyrimidin-4-yl)spiro[4a,9a-dihydroxanthene-9,9'-fluorene]-2'-yl]phenyl]quinoline
CID 146547855
2-(4-dibenzofuran-4-ylphenyl)-6-phenyl-4-(4-spiro[fluorene-9,9'-xanthene]-4'-ylphenyl)-1,4-dihydro-1,3,5-triazine
CID 146321898
CID 146184431
CID 146184431
5-[6'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-3'-yl]isoquinoline
CID 146547947
2,6-diphenyl-4-(4-phenylphenyl)pyridine;2,6-diphenyl-4-(4-pyridin-3-ylphenyl)pyridine;5-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]isoquinoline;5-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]quinoline
CID 160905421
2,4-diphenyl-6-[3-(7-pyridin-3-ylspiro[fluorene-9,9'-xanthene]-2-yl)phenyl]-1,4-dihydro-1,3,5-triazine
CID 129263235
5-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]quinoline
CID 122416200

Frequently Asked Questions

What is the IUPAC name of 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline?
The IUPAC name of 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline (CID 165102916) is 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline.
What is the SMILES notation for 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline?
The canonical SMILES for 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline is C1=CC2C(Oc3c(-c4ccc(-c5cccc6ncccc56)cc4)cccc3C23c2ccccc2-c2ccccc23)C(C2=NC(c3ccccc3)N=C(c3ccccc3)N2)=C1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3c(-c5ccc(-c6ccnc7ccccc67)cc5)cccc3C43c4ccccc4-c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3c(-c5cccc6cnccc56)cccc3C43c4ccccc4-c4ccccc43)n2)cc1.
What is the InChIKey of 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline?
The InChIKey is YQFSXWHTWOMPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H34N4O.C55H38N4O.C49H30N4O/c1-3-15-37(16-4-1)52-57-53(38-17-5-2-6-18-38)59-54(58-52)44-23-14-27-48-51(44)60-50-40(36-31-29-35(30-32-36)39-33-34-56-49-28-12-9-21-43(39)49)22-13-26-47(50)55(48)45-24-10-7-19-41(45)42-20-8-11-25-46(42)55;1-3-15-37(16-4-1)52-57-53(38-17-5-2-6-18-38)59-54(58-52)44-23-12-28-48-51(44)60-50-40(36-32-30-35(31-33-36)39-21-13-29-49-43(39)24-14-34-56-49)22-11-27-47(50)55(48)45-25-9-7-19-41(45)42-20-8-10-26-46(42)55;1-3-14-31(15-4-1)46-51-47(32-16-5-2-6-17-32)53-48(52-46)39-23-13-27-43-45(39)54-44-38(35-21-11-18-33-30-50-29-28-34(33)35)22-12-26-42(44)49(43)40-24-9-7-19-36(40)37-20-8-10-25-41(37)49/h1-34H;1-34,48,51-52H,(H,57,58,59);1-30H.
What are the key properties of 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline?
5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline has a molecular weight of 2228.65 g/mol, XLogP of 36.68, 14 rotatable bonds, 1 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[5-(4,6-diphenyl-1,4-dihydro-1,3,5-triazin-2-yl)spiro[8a,10a-dihydroxanthene-9,9'-fluorene]-4-yl]phenyl]quinoline;5-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]isoquinoline;4-[4-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-4'-yl]phenyl]quinoline is sourced from PubChem (CID 165102916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).