4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole

C272H176N24 — CID 157100757

IUPAC4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole
SMILESc1ccc(-c2c3ccccc3c(-c3cc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c4nn(-c5cccc(-c6cccnc6)c5)nc4c3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6ccc(-c7cccnc7)cc6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6ccc(-c7ccncc7)cc6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6cccc(-c7cccnc7)c6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6cccc(-c7ccncc7)c6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5nn(-c6ccc(-c7cccnc7)cc6)nc5c4)c3)c3ccccc23)cc1
InChIInChI=1S/C57H36N4.5C43H28N4/c1-3-17-37(18-4-1)53-43-24-7-9-26-45(43)55(46-27-10-8-25-44(46)53)41-34-51(57-52(35-41)59-61(60-57)42-23-15-21-39(33-42)40-22-16-32-58-36-40)56-49-30-13-11-28-47(49)54(38-19-5-2-6-20-38)48-29-12-14-31-50(48)56;1-2-10-30(11-3-1)42-36-15-4-6-17-38(36)43(39-18-7-5-16-37(39)42)31-21-19-29(20-22-31)33-23-24-40-41(27-33)46-47(45-40)35-14-8-12-32(26-35)34-13-9-25-44-28-34;1-2-10-30(11-3-1)42-36-15-4-6-17-38(36)43(39-18-7-5-16-37(39)42)33-13-8-12-31(26-33)32-21-24-40-41(27-32)46-47(45-40)35-22-19-29(20-23-35)34-14-9-25-44-28-34;1-2-9-31(10-3-1)42-36-13-4-6-15-38(36)43(39-16-7-5-14-37(39)42)32-19-17-29(18-20-32)34-21-22-40-41(28-34)46-47(45-40)35-12-8-11-33(27-35)30-23-25-44-26-24-30;1-2-9-31(10-3-1)42-36-12-4-6-14-38(36)43(39-15-7-5-13-37(39)42)32-18-16-29(17-19-32)33-22-25-40-41(27-33)46-47(45-40)35-23-20-30(21-24-35)34-11-8-26-44-28-34;1-2-8-32(9-3-1)42-36-10-4-6-12-38(36)43(39-13-7-5-11-37(39)42)33-16-14-30(15-17-33)34-20-23-40-41(28-34)46-47(45-40)35-21-18-29(19-22-35)31-24-26-44-27-25-31/h1-36H;5*1-28H
InChIKeyAFSUZFJKIXUUCR-UHFFFAOYSA-N
MW3780.57 g/mol
LogP68.71
Rot. Bonds31

About 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole

4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole (PubChem CID 157100757) has the molecular formula C272H176N24 and a molecular weight of 3780.57 g/mol. Its IUPAC name is 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole.

Molecular Properties

Compound Name4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole
PubChem CID157100757
Molecular FormulaC272H176N24
Molecular Weight3780.57 g/mol
Exact Mass3777.45
IUPAC Name4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole
SMILESc1ccc(-c2c3ccccc3c(-c3cc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c4nn(-c5cccc(-c6cccnc6)c5)nc4c3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6ccc(-c7cccnc7)cc6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6ccc(-c7ccncc7)cc6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6cccc(-c7cccnc7)c6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6cccc(-c7ccncc7)c6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5nn(-c6ccc(-c7cccnc7)cc6)nc5c4)c3)c3ccccc23)cc1
InChIInChI=1S/C57H36N4.5C43H28N4/c1-3-17-37(18-4-1)53-43-24-7-9-26-45(43)55(46-27-10-8-25-44(46)53)41-34-51(57-52(35-41)59-61(60-57)42-23-15-21-39(33-42)40-22-16-32-58-36-40)56-49-30-13-11-28-47(49)54(38-19-5-2-6-20-38)48-29-12-14-31-50(48)56;1-2-10-30(11-3-1)42-36-15-4-6-17-38(36)43(39-18-7-5-16-37(39)42)31-21-19-29(20-22-31)33-23-24-40-41(27-33)46-47(45-40)35-14-8-12-32(26-35)34-13-9-25-44-28-34;1-2-10-30(11-3-1)42-36-15-4-6-17-38(36)43(39-18-7-5-16-37(39)42)33-13-8-12-31(26-33)32-21-24-40-41(27-32)46-47(45-40)35-22-19-29(20-23-35)34-14-9-25-44-28-34;1-2-9-31(10-3-1)42-36-13-4-6-15-38(36)43(39-16-7-5-14-37(39)42)32-19-17-29(18-20-32)34-21-22-40-41(28-34)46-47(45-40)35-12-8-11-33(27-35)30-23-25-44-26-24-30;1-2-9-31(10-3-1)42-36-12-4-6-14-38(36)43(39-15-7-5-13-37(39)42)32-18-16-29(17-19-32)33-22-25-40-41(27-33)46-47(45-40)35-23-20-30(21-24-35)34-11-8-26-44-28-34;1-2-8-32(9-3-1)42-36-10-4-6-12-38(36)43(39-13-7-5-11-37(39)42)33-16-14-30(15-17-33)34-20-23-40-41(28-34)46-47(45-40)35-21-18-29(19-22-35)31-24-26-44-27-25-31/h1-36H;5*1-28H
InChIKeyAFSUZFJKIXUUCR-UHFFFAOYSA-N
XLogP68.71
TPSA261.60 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds31
Heavy Atoms296
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003780.57
LogP ≤ 568.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole?
The IUPAC name of 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole (CID 157100757) is 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole.
What is the SMILES notation for 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole?
The canonical SMILES for 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole is c1ccc(-c2c3ccccc3c(-c3cc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c4nn(-c5cccc(-c6cccnc6)c5)nc4c3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6ccc(-c7cccnc7)cc6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6ccc(-c7ccncc7)cc6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6cccc(-c7cccnc7)c6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5nn(-c6cccc(-c7ccncc7)c6)nc5c4)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5nn(-c6ccc(-c7cccnc7)cc6)nc5c4)c3)c3ccccc23)cc1.
What is the InChIKey of 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole?
The InChIKey is AFSUZFJKIXUUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36N4.5C43H28N4/c1-3-17-37(18-4-1)53-43-24-7-9-26-45(43)55(46-27-10-8-25-44(46)53)41-34-51(57-52(35-41)59-61(60-57)42-23-15-21-39(33-42)40-22-16-32-58-36-40)56-49-30-13-11-28-47(49)54(38-19-5-2-6-20-38)48-29-12-14-31-50(48)56;1-2-10-30(11-3-1)42-36-15-4-6-17-38(36)43(39-18-7-5-16-37(39)42)31-21-19-29(20-22-31)33-23-24-40-41(27-33)46-47(45-40)35-14-8-12-32(26-35)34-13-9-25-44-28-34;1-2-10-30(11-3-1)42-36-15-4-6-17-38(36)43(39-18-7-5-16-37(39)42)33-13-8-12-31(26-33)32-21-24-40-41(27-32)46-47(45-40)35-22-19-29(20-23-35)34-14-9-25-44-28-34;1-2-9-31(10-3-1)42-36-13-4-6-15-38(36)43(39-16-7-5-14-37(39)42)32-19-17-29(18-20-32)34-21-22-40-41(28-34)46-47(45-40)35-12-8-11-33(27-35)30-23-25-44-26-24-30;1-2-9-31(10-3-1)42-36-12-4-6-14-38(36)43(39-15-7-5-13-37(39)42)32-18-16-29(17-19-32)33-22-25-40-41(27-33)46-47(45-40)35-23-20-30(21-24-35)34-11-8-26-44-28-34;1-2-8-32(9-3-1)42-36-10-4-6-12-38(36)43(39-13-7-5-11-37(39)42)33-16-14-30(15-17-33)34-20-23-40-41(28-34)46-47(45-40)35-21-18-29(19-22-35)31-24-26-44-27-25-31/h1-36H;5*1-28H.
What are the key properties of 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole?
4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole has a molecular weight of 3780.57 g/mol, XLogP of 68.71, 31 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(10-phenylanthracen-9-yl)-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[3-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(3-pyridin-4-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-3-ylphenyl)benzotriazole;5-[4-(10-phenylanthracen-9-yl)phenyl]-2-(4-pyridin-4-ylphenyl)benzotriazole is sourced from PubChem (CID 157100757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).