9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole

C135H88N12 — CID 161062041

IUPAC9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc(-n5c6ccccc6c6ccccc65)c5ccccc45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccccc3-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)n2)cc1
InChIInChI=1S/2C49H32N4.C37H24N4/c1-3-17-33(18-4-1)35-21-7-11-27-41(35)47-50-48(42-28-12-8-22-36(42)34-19-5-2-6-20-34)52-49(51-47)43-31-32-46(38-24-10-9-23-37(38)43)53-44-29-15-13-25-39(44)40-26-14-16-30-45(40)53;1-3-15-33(16-4-1)35-19-13-21-37(31-35)47-50-48(38-22-14-20-36(32-38)34-17-5-2-6-18-34)52-49(51-47)43-29-30-46(40-24-8-7-23-39(40)43)53-44-27-11-9-25-41(44)42-26-10-12-28-45(42)53;1-3-13-25(14-4-1)35-38-36(26-15-5-2-6-16-26)40-37(39-35)31-23-24-34(28-18-8-7-17-27(28)31)41-32-21-11-9-19-29(32)30-20-10-12-22-33(30)41/h2*1-32H;1-24H
InChIKeyUDNHJYNGXDRZKO-UHFFFAOYSA-N
MW1878.27 g/mol
LogP34.04
Rot. Bonds16

About 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole

9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole (PubChem CID 161062041) has the molecular formula C135H88N12 and a molecular weight of 1878.27 g/mol. Its IUPAC name is 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole.

Molecular Properties

Compound Name9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole
PubChem CID161062041
Molecular FormulaC135H88N12
Molecular Weight1878.27 g/mol
Exact Mass1876.73
IUPAC Name9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc(-n5c6ccccc6c6ccccc65)c5ccccc45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccccc3-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)n2)cc1
InChIInChI=1S/2C49H32N4.C37H24N4/c1-3-17-33(18-4-1)35-21-7-11-27-41(35)47-50-48(42-28-12-8-22-36(42)34-19-5-2-6-20-34)52-49(51-47)43-31-32-46(38-24-10-9-23-37(38)43)53-44-29-15-13-25-39(44)40-26-14-16-30-45(40)53;1-3-15-33(16-4-1)35-19-13-21-37(31-35)47-50-48(38-22-14-20-36(32-38)34-17-5-2-6-18-34)52-49(51-47)43-29-30-46(40-24-8-7-23-39(40)43)53-44-27-11-9-25-41(44)42-26-10-12-28-45(42)53;1-3-13-25(14-4-1)35-38-36(26-15-5-2-6-16-26)40-37(39-35)31-23-24-34(28-18-8-7-17-27(28)31)41-32-21-11-9-19-29(32)30-20-10-12-22-33(30)41/h2*1-32H;1-24H
InChIKeyUDNHJYNGXDRZKO-UHFFFAOYSA-N
XLogP34.04
TPSA130.80 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds16
Heavy Atoms147
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001878.27
LogP ≤ 534.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole?
The IUPAC name of 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole (CID 161062041) is 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole.
What is the SMILES notation for 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole?
The canonical SMILES for 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole is c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc(-n5c6ccccc6c6ccccc65)c5ccccc45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccccc3-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)n2)cc1.
What is the InChIKey of 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole?
The InChIKey is UDNHJYNGXDRZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C49H32N4.C37H24N4/c1-3-17-33(18-4-1)35-21-7-11-27-41(35)47-50-48(42-28-12-8-22-36(42)34-19-5-2-6-20-34)52-49(51-47)43-31-32-46(38-24-10-9-23-37(38)43)53-44-29-15-13-25-39(44)40-26-14-16-30-45(40)53;1-3-15-33(16-4-1)35-19-13-21-37(31-35)47-50-48(38-22-14-20-36(32-38)34-17-5-2-6-18-34)52-49(51-47)43-29-30-46(40-24-8-7-23-39(40)43)53-44-27-11-9-25-41(44)42-26-10-12-28-45(42)53;1-3-13-25(14-4-1)35-38-36(26-15-5-2-6-16-26)40-37(39-35)31-23-24-34(28-18-8-7-17-27(28)31)41-32-21-11-9-19-29(32)30-20-10-12-22-33(30)41/h2*1-32H;1-24H.
What are the key properties of 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole?
9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole has a molecular weight of 1878.27 g/mol, XLogP of 34.04, 16 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]carbazole is sourced from PubChem (CID 161062041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).