2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline

C274H170N16 — CID 159482909

IUPAC2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cc5cccnc5c5ncccc45)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5ccc6cccnc6c5n4)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-c5cc6ccc(-c7ccccn7)nc6c6nc(-c7ccccn7)ccc56)c4)ccc23)cc1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5cc6cccnc6c6ncccc56)cc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5ccc6ccc7cccnc7c6n5)cc34)ccc2c1.c1ccc2cc3cc(-c4cc5cccnc5c5ncccc45)ccc3cc2c1.c1ccc2cc3cc(-c4ccc5ccc6cccnc6c5n4)ccc3cc2c1
InChIInChI=1S/C54H34N4.2C46H28N2.2C38H24N2.2C26H16N2/c1-3-14-35(15-4-1)51-41-20-7-8-21-42(41)52(36-16-5-2-6-17-36)46-33-38(24-26-43(46)51)37-18-13-19-39(32-37)45-34-40-25-28-49(47-22-9-11-30-55-47)57-53(40)54-44(45)27-29-50(58-54)48-23-10-12-31-56-48;1-2-12-31-26-33(21-20-29(31)10-1)43-37-16-5-6-17-38(37)44(36-18-7-13-30-11-3-4-15-35(30)36)39-23-22-32(27-42(39)43)41-28-34-14-8-24-47-45(34)46-40(41)19-9-25-48-46;1-2-11-33-27-35(21-18-29(33)9-1)43-38-15-5-6-16-39(38)44(37-17-7-12-30-10-3-4-14-36(30)37)40-24-22-34(28-41(40)43)42-25-23-32-20-19-31-13-8-26-47-45(31)46(32)48-42;1-3-11-25(12-4-1)35-29-16-7-8-17-30(29)36(26-13-5-2-6-14-26)34-23-27(19-20-31(34)35)33-24-28-15-9-21-39-37(28)38-32(33)18-10-22-40-38;1-3-10-25(11-4-1)35-30-15-7-8-16-31(30)36(26-12-5-2-6-13-26)33-24-29(19-21-32(33)35)34-22-20-28-18-17-27-14-9-23-39-37(27)38(28)40-34;1-2-6-18-14-22-15-20(10-9-19(22)13-17(18)5-1)24-16-21-7-3-11-27-25(21)26-23(24)8-4-12-28-26;1-2-5-20-15-23-16-22(10-9-21(23)14-19(20)4-1)24-12-11-18-8-7-17-6-3-13-27-25(17)26(18)28-24/h1-34H;2*1-28H;2*1-24H;2*1-16H
InChIKeyLXFMVVLTTJDBBL-UHFFFAOYSA-N
MW3686.49 g/mol
LogP72.37
Rot. Bonds20

About 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline

2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline (PubChem CID 159482909) has the molecular formula C274H170N16 and a molecular weight of 3686.49 g/mol. Its IUPAC name is 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline.

Molecular Properties

Compound Name2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline
PubChem CID159482909
Molecular FormulaC274H170N16
Molecular Weight3686.49 g/mol
Exact Mass3683.38
IUPAC Name2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cc5cccnc5c5ncccc45)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5ccc6cccnc6c5n4)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-c5cc6ccc(-c7ccccn7)nc6c6nc(-c7ccccn7)ccc56)c4)ccc23)cc1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5cc6cccnc6c6ncccc56)cc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5ccc6ccc7cccnc7c6n5)cc34)ccc2c1.c1ccc2cc3cc(-c4cc5cccnc5c5ncccc45)ccc3cc2c1.c1ccc2cc3cc(-c4ccc5ccc6cccnc6c5n4)ccc3cc2c1
InChIInChI=1S/C54H34N4.2C46H28N2.2C38H24N2.2C26H16N2/c1-3-14-35(15-4-1)51-41-20-7-8-21-42(41)52(36-16-5-2-6-17-36)46-33-38(24-26-43(46)51)37-18-13-19-39(32-37)45-34-40-25-28-49(47-22-9-11-30-55-47)57-53(40)54-44(45)27-29-50(58-54)48-23-10-12-31-56-48;1-2-12-31-26-33(21-20-29(31)10-1)43-37-16-5-6-17-38(37)44(36-18-7-13-30-11-3-4-15-35(30)36)39-23-22-32(27-42(39)43)41-28-34-14-8-24-47-45(34)46-40(41)19-9-25-48-46;1-2-11-33-27-35(21-18-29(33)9-1)43-38-15-5-6-16-39(38)44(37-17-7-12-30-10-3-4-14-36(30)37)40-24-22-34(28-41(40)43)42-25-23-32-20-19-31-13-8-26-47-45(31)46(32)48-42;1-3-11-25(12-4-1)35-29-16-7-8-17-30(29)36(26-13-5-2-6-14-26)34-23-27(19-20-31(34)35)33-24-28-15-9-21-39-37(28)38-32(33)18-10-22-40-38;1-3-10-25(11-4-1)35-30-15-7-8-16-31(30)36(26-12-5-2-6-13-26)33-24-29(19-21-32(33)35)34-22-20-28-18-17-27-14-9-23-39-37(27)38(28)40-34;1-2-6-18-14-22-15-20(10-9-19(22)13-17(18)5-1)24-16-21-7-3-11-27-25(21)26-23(24)8-4-12-28-26;1-2-5-20-15-23-16-22(10-9-21(23)14-19(20)4-1)24-12-11-18-8-7-17-6-3-13-27-25(17)26(18)28-24/h1-34H;2*1-28H;2*1-24H;2*1-16H
InChIKeyLXFMVVLTTJDBBL-UHFFFAOYSA-N
XLogP72.37
TPSA206.24 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds20
Heavy Atoms290
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003686.49
LogP ≤ 572.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline?
The IUPAC name of 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline (CID 159482909) is 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline.
What is the SMILES notation for 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline?
The canonical SMILES for 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline is c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cc5cccnc5c5ncccc45)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5ccc6cccnc6c5n4)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-c5cc6ccc(-c7ccccn7)nc6c6nc(-c7ccccn7)ccc56)c4)ccc23)cc1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5cc6cccnc6c6ncccc56)cc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5ccc6ccc7cccnc7c6n5)cc34)ccc2c1.c1ccc2cc3cc(-c4cc5cccnc5c5ncccc45)ccc3cc2c1.c1ccc2cc3cc(-c4ccc5ccc6cccnc6c5n4)ccc3cc2c1.
What is the InChIKey of 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline?
The InChIKey is LXFMVVLTTJDBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N4.2C46H28N2.2C38H24N2.2C26H16N2/c1-3-14-35(15-4-1)51-41-20-7-8-21-42(41)52(36-16-5-2-6-17-36)46-33-38(24-26-43(46)51)37-18-13-19-39(32-37)45-34-40-25-28-49(47-22-9-11-30-55-47)57-53(40)54-44(45)27-29-50(58-54)48-23-10-12-31-56-48;1-2-12-31-26-33(21-20-29(31)10-1)43-37-16-5-6-17-38(37)44(36-18-7-13-30-11-3-4-15-35(30)36)39-23-22-32(27-42(39)43)41-28-34-14-8-24-47-45(34)46-40(41)19-9-25-48-46;1-2-11-33-27-35(21-18-29(33)9-1)43-38-15-5-6-16-39(38)44(37-17-7-12-30-10-3-4-14-36(30)37)40-24-22-34(28-41(40)43)42-25-23-32-20-19-31-13-8-26-47-45(31)46(32)48-42;1-3-11-25(12-4-1)35-29-16-7-8-17-30(29)36(26-13-5-2-6-14-26)34-23-27(19-20-31(34)35)33-24-28-15-9-21-39-37(28)38-32(33)18-10-22-40-38;1-3-10-25(11-4-1)35-30-15-7-8-16-31(30)36(26-12-5-2-6-13-26)33-24-29(19-21-32(33)35)34-22-20-28-18-17-27-14-9-23-39-37(27)38(28)40-34;1-2-6-18-14-22-15-20(10-9-19(22)13-17(18)5-1)24-16-21-7-3-11-27-25(21)26-23(24)8-4-12-28-26;1-2-5-20-15-23-16-22(10-9-21(23)14-19(20)4-1)24-12-11-18-8-7-17-6-3-13-27-25(17)26(18)28-24/h1-34H;2*1-28H;2*1-24H;2*1-16H.
What are the key properties of 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline?
2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline has a molecular weight of 3686.49 g/mol, XLogP of 72.37, 20 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline is sourced from PubChem (CID 159482909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).