6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]

C174H103N3O3 — CID 163588027

IUPAC6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
SMILESc1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2nc3ccccc3c3cc4c(cc23)Oc2ccccc2C42c3ccccc3-c3ccccc32)c1.c1ccc(-c2nc3ccc(-c4ccc(-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)cc3c3c4c(ccc23)C2(c3ccccc3O4)c3ccccc3-c3ccccc32)cc1.c1ccc2c(c1)Oc1cc3c(-c4ccc(-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)nc4ccccc4c3cc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C62H37NO.2C56H33NO/c1-2-14-40(15-3-1)60-50-33-34-56-61(64-58-25-13-12-24-55(58)62(56)53-22-10-8-20-48(53)49-21-9-11-23-54(49)62)59(50)52-37-42(31-35-57(52)63-60)39-28-26-38(27-29-39)41-30-32-47-45-18-5-4-16-43(45)44-17-6-7-19-46(44)51(47)36-41;1-2-18-39-37(16-1)38-17-3-4-19-40(38)45-31-35(28-29-41(39)45)34-14-13-15-36(30-34)55-47-33-54-51(32-46(47)44-22-7-11-26-52(44)57-55)56(50-25-10-12-27-53(50)58-54)48-23-8-5-20-42(48)43-21-6-9-24-49(43)56;1-2-15-39-37(13-1)38-14-3-4-16-40(38)45-31-36(29-30-41(39)45)34-25-27-35(28-26-34)55-47-33-54-51(32-46(47)44-19-7-11-23-52(44)57-55)56(50-22-10-12-24-53(50)58-54)48-20-8-5-17-42(48)43-18-6-9-21-49(43)56/h1-37H;2*1-33H
InChIKeyGNDMGJRJZUPOFR-UHFFFAOYSA-N
MW2283.76 g/mol
LogP45.62
Rot. Bonds7

About 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]

6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene] (PubChem CID 163588027) has the molecular formula C174H103N3O3 and a molecular weight of 2283.76 g/mol. Its IUPAC name is 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene].

Molecular Properties

Compound Name6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
PubChem CID163588027
Molecular FormulaC174H103N3O3
Molecular Weight2283.76 g/mol
Exact Mass2281.80
IUPAC Name6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
SMILESc1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2nc3ccccc3c3cc4c(cc23)Oc2ccccc2C42c3ccccc3-c3ccccc32)c1.c1ccc(-c2nc3ccc(-c4ccc(-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)cc3c3c4c(ccc23)C2(c3ccccc3O4)c3ccccc3-c3ccccc32)cc1.c1ccc2c(c1)Oc1cc3c(-c4ccc(-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)nc4ccccc4c3cc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C62H37NO.2C56H33NO/c1-2-14-40(15-3-1)60-50-33-34-56-61(64-58-25-13-12-24-55(58)62(56)53-22-10-8-20-48(53)49-21-9-11-23-54(49)62)59(50)52-37-42(31-35-57(52)63-60)39-28-26-38(27-29-39)41-30-32-47-45-18-5-4-16-43(45)44-17-6-7-19-46(44)51(47)36-41;1-2-18-39-37(16-1)38-17-3-4-19-40(38)45-31-35(28-29-41(39)45)34-14-13-15-36(30-34)55-47-33-54-51(32-46(47)44-22-7-11-26-52(44)57-55)56(50-25-10-12-27-53(50)58-54)48-23-8-5-20-42(48)43-21-6-9-24-49(43)56;1-2-15-39-37(13-1)38-14-3-4-16-40(38)45-31-36(29-30-41(39)45)34-25-27-35(28-26-34)55-47-33-54-51(32-46(47)44-19-7-11-23-52(44)57-55)56(50-22-10-12-24-53(50)58-54)48-20-8-5-17-42(48)43-18-6-9-21-49(43)56/h1-37H;2*1-33H
InChIKeyGNDMGJRJZUPOFR-UHFFFAOYSA-N
XLogP45.62
TPSA66.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms180
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002283.76
LogP ≤ 545.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene] with MolForge

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Related Compounds

6-[3-[4-(2-phenylquinazolin-4-yl)phenyl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene]
CID 162694337
6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene]
CID 163435686
6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
CID 146613600
3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenylspiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-phenyl-3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene]
CID 163490374
6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene]
CID 162694633
6-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene]
CID 163501802
6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
CID 163631721
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenylspiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
CID 162694494
21-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]spiro[20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,9'-xanthene]
CID 152788019
2-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-6-phenylspiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]
CID 162694250
21-phenyl-17-[10-(4-phenylphenyl)anthracen-9-yl]spiro[20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14(19),15,17,20-decaene-10,9'-xanthene]
CID 164737400
6-phenyl-3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene]
CID 162694279

Frequently Asked Questions

What is the IUPAC name of 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]?
The IUPAC name of 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene] (CID 163588027) is 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene].
What is the SMILES notation for 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]?
The canonical SMILES for 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene] is c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2nc3ccccc3c3cc4c(cc23)Oc2ccccc2C42c3ccccc3-c3ccccc32)c1.c1ccc(-c2nc3ccc(-c4ccc(-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)cc3c3c4c(ccc23)C2(c3ccccc3O4)c3ccccc3-c3ccccc32)cc1.c1ccc2c(c1)Oc1cc3c(-c4ccc(-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)nc4ccccc4c3cc1C21c2ccccc2-c2ccccc21.
What is the InChIKey of 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]?
The InChIKey is GNDMGJRJZUPOFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H37NO.2C56H33NO/c1-2-14-40(15-3-1)60-50-33-34-56-61(64-58-25-13-12-24-55(58)62(56)53-22-10-8-20-48(53)49-21-9-11-23-54(49)62)59(50)52-37-42(31-35-57(52)63-60)39-28-26-38(27-29-39)41-30-32-47-45-18-5-4-16-43(45)44-17-6-7-19-46(44)51(47)36-41;1-2-18-39-37(16-1)38-17-3-4-19-40(38)45-31-35(28-29-41(39)45)34-14-13-15-36(30-34)55-47-33-54-51(32-46(47)44-22-7-11-26-52(44)57-55)56(50-25-10-12-27-53(50)58-54)48-23-8-5-20-42(48)43-21-6-9-24-49(43)56;1-2-15-39-37(13-1)38-14-3-4-16-40(38)45-31-36(29-30-41(39)45)34-25-27-35(28-26-34)55-47-33-54-51(32-46(47)44-19-7-11-23-52(44)57-55)56(50-22-10-12-24-53(50)58-54)48-20-8-5-17-42(48)43-18-6-9-21-49(43)56/h1-37H;2*1-33H.
What are the key properties of 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene]?
6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene] has a molecular weight of 2283.76 g/mol, XLogP of 45.62, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-2-(4-triphenylen-2-ylphenyl)spiro[chromeno[3,2-k]phenanthridine-9,9'-fluorene];6-(3-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene];6-(4-triphenylen-2-ylphenyl)spiro[chromeno[2,3-j]phenanthridine-13,9'-fluorene] is sourced from PubChem (CID 163588027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).