9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine

C231H155N15S — CID 158653624

IUPAC9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine
SMILES[2H]c1c([2H])c([2H])c(-c2ccc(N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc32)c([2H])c1[2H].c1ccc(-c2ccc(N(c3ccc4c(c3)c3ccccc3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc3-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c3)c2)cc1
InChIInChI=1S/C63H42N6.C60H39N3S.2C54H37N3/c1-5-19-43(20-6-1)44-33-36-49(37-34-44)67(56-30-16-13-27-51(56)47-35-39-54-52-28-14-17-31-57(52)68(60(54)41-47)48-25-11-4-12-26-48)50-38-40-59-55(42-50)53-29-15-18-32-58(53)69(59)63-65-61(45-21-7-2-8-22-45)64-62(66-63)46-23-9-3-10-24-46;1-3-15-40(16-4-1)41-17-13-21-45(35-41)61(46-22-14-18-42(36-46)43-29-32-51-49-23-7-10-26-55(49)62(57(51)37-43)44-19-5-2-6-20-44)48-30-33-52-50-24-8-11-27-56(50)63(58(52)39-48)47-31-34-60-54(38-47)53-25-9-12-28-59(53)64-60;1-4-16-38(17-5-1)39-28-31-43(32-29-39)55(44-33-35-49-47-24-12-15-27-52(47)57(54(49)37-44)42-20-8-3-9-21-42)50-25-13-10-22-45(50)40-30-34-48-46-23-11-14-26-51(46)56(53(48)36-40)41-18-6-2-7-19-41;1-4-15-38(16-5-1)39-27-30-44(31-28-39)55(46-32-34-53-50(37-46)48-24-11-13-26-52(48)56(53)42-18-6-2-7-19-42)45-22-14-17-40(35-45)41-29-33-49-47-23-10-12-25-51(47)57(54(49)36-41)43-20-8-3-9-21-43/h1-42H;1-39H;2*1-37H/i;;3D,8D,9D,20D,21D;1D,4D,5D,15D,16D
InChIKeyIBVWAMVADMSVDY-UEFKJLCESA-N
MW3183.01 g/mol
LogP62.63
Rot. Bonds30

About 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine

9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine (PubChem CID 158653624) has the molecular formula C231H155N15S and a molecular weight of 3183.01 g/mol. Its IUPAC name is 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine.

Molecular Properties

Compound Name9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine
PubChem CID158653624
Molecular FormulaC231H155N15S
Molecular Weight3183.01 g/mol
Exact Mass3180.29
IUPAC Name9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine
SMILES[2H]c1c([2H])c([2H])c(-c2ccc(N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc32)c([2H])c1[2H].c1ccc(-c2ccc(N(c3ccc4c(c3)c3ccccc3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc3-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c3)c2)cc1
InChIInChI=1S/C63H42N6.C60H39N3S.2C54H37N3/c1-5-19-43(20-6-1)44-33-36-49(37-34-44)67(56-30-16-13-27-51(56)47-35-39-54-52-28-14-17-31-57(52)68(60(54)41-47)48-25-11-4-12-26-48)50-38-40-59-55(42-50)53-29-15-18-32-58(53)69(59)63-65-61(45-21-7-2-8-22-45)64-62(66-63)46-23-9-3-10-24-46;1-3-15-40(16-4-1)41-17-13-21-45(35-41)61(46-22-14-18-42(36-46)43-29-32-51-49-23-7-10-26-55(49)62(57(51)37-43)44-19-5-2-6-20-44)48-30-33-52-50-24-8-11-27-56(50)63(58(52)39-48)47-31-34-60-54(38-47)53-25-9-12-28-59(53)64-60;1-4-16-38(17-5-1)39-28-31-43(32-29-39)55(44-33-35-49-47-24-12-15-27-52(47)57(54(49)37-44)42-20-8-3-9-21-42)50-25-13-10-22-45(50)40-30-34-48-46-23-11-14-26-51(46)56(53(48)36-40)41-18-6-2-7-19-41;1-4-15-38(16-5-1)39-27-30-44(31-28-39)55(46-32-34-53-50(37-46)48-24-11-13-26-52(48)56(53)42-18-6-2-7-19-42)45-22-14-17-40(35-45)41-29-33-49-47-23-10-12-25-51(47)57(54(49)36-41)43-20-8-3-9-21-43/h1-42H;1-39H;2*1-37H/i;;3D,8D,9D,20D,21D;1D,4D,5D,15D,16D
InChIKeyIBVWAMVADMSVDY-UEFKJLCESA-N
XLogP62.63
TPSA91.07 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds30
Heavy Atoms247
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003183.01
LogP ≤ 562.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine?
The IUPAC name of 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine (CID 158653624) is 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine.
What is the SMILES notation for 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine?
The canonical SMILES for 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine is [2H]c1c([2H])c([2H])c(-c2ccc(N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc32)c([2H])c1[2H].c1ccc(-c2ccc(N(c3ccc4c(c3)c3ccccc3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc3-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c3)c2)cc1.
What is the InChIKey of 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine?
The InChIKey is IBVWAMVADMSVDY-UEFKJLCESA-N. The full InChI is InChI=1S/C63H42N6.C60H39N3S.2C54H37N3/c1-5-19-43(20-6-1)44-33-36-49(37-34-44)67(56-30-16-13-27-51(56)47-35-39-54-52-28-14-17-31-57(52)68(60(54)41-47)48-25-11-4-12-26-48)50-38-40-59-55(42-50)53-29-15-18-32-58(53)69(59)63-65-61(45-21-7-2-8-22-45)64-62(66-63)46-23-9-3-10-24-46;1-3-15-40(16-4-1)41-17-13-21-45(35-41)61(46-22-14-18-42(36-46)43-29-32-51-49-23-7-10-26-55(49)62(57(51)37-43)44-19-5-2-6-20-44)48-30-33-52-50-24-8-11-27-56(50)63(58(52)39-48)47-31-34-60-54(38-47)53-25-9-12-28-59(53)64-60;1-4-16-38(17-5-1)39-28-31-43(32-29-39)55(44-33-35-49-47-24-12-15-27-52(47)57(54(49)37-44)42-20-8-3-9-21-42)50-25-13-10-22-45(50)40-30-34-48-46-23-11-14-26-51(46)56(53(48)36-40)41-18-6-2-7-19-41;1-4-15-38(16-5-1)39-27-30-44(31-28-39)55(46-32-34-53-50(37-46)48-24-11-13-26-52(48)56(53)42-18-6-2-7-19-42)45-22-14-17-40(35-45)41-29-33-49-47-23-10-12-25-51(47)57(54(49)36-41)43-20-8-3-9-21-43/h1-42H;1-39H;2*1-37H/i;;3D,8D,9D,20D,21D;1D,4D,5D,15D,16D.
What are the key properties of 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine?
9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine has a molecular weight of 3183.01 g/mol, XLogP of 62.63, 30 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzothiophen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-[2-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-amine is sourced from PubChem (CID 158653624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).