4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine

C66H54N8 — CID 177073889

IUPAC4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
SMILESCc1cc(C)c(N(c2ccc(N(c3nc(-c4ccccc4)nc(-c4ccc(-c5ccccc5)cc4)n3)c3nc(-c4ccccc4)nc(-c4ccccc4-c4ccccc4)n3)cc2)c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C66H54N8/c1-43-39-45(3)59(46(4)40-43)73(60-47(5)41-44(2)42-48(60)6)55-35-37-56(38-36-55)74(65-69-61(52-25-15-9-16-26-52)67-63(71-65)54-33-31-50(32-34-54)49-21-11-7-12-22-49)66-70-62(53-27-17-10-18-28-53)68-64(72-66)58-30-20-19-29-57(58)51-23-13-8-14-24-51/h7-42H,1-6H3
InChIKeyBEAQRNAZNKTYPJ-UHFFFAOYSA-N
MW959.21 g/mol
LogP16.85
Rot. Bonds12

About 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine

4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine (PubChem CID 177073889) has the molecular formula C66H54N8 and a molecular weight of 959.21 g/mol. Its IUPAC name is 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine.

Molecular Properties

Compound Name4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
PubChem CID177073889
Molecular FormulaC66H54N8
Molecular Weight959.21 g/mol
Exact Mass958.45
IUPAC Name4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
SMILESCc1cc(C)c(N(c2ccc(N(c3nc(-c4ccccc4)nc(-c4ccc(-c5ccccc5)cc4)n3)c3nc(-c4ccccc4)nc(-c4ccccc4-c4ccccc4)n3)cc2)c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C66H54N8/c1-43-39-45(3)59(46(4)40-43)73(60-47(5)41-44(2)42-48(60)6)55-35-37-56(38-36-55)74(65-69-61(52-25-15-9-16-26-52)67-63(71-65)54-33-31-50(32-34-54)49-21-11-7-12-22-49)66-70-62(53-27-17-10-18-28-53)68-64(72-66)58-30-20-19-29-57(58)51-23-13-8-14-24-51/h7-42H,1-6H3
InChIKeyBEAQRNAZNKTYPJ-UHFFFAOYSA-N
XLogP16.85
TPSA83.82 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms74
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500959.21
LogP ≤ 516.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-N-(4,6-diphenyl-1,3,5-triazin-2-yl)-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177074330
1-N-(4,6-diphenyl-1,3,5-triazin-2-yl)-1-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-4-N,4-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177074356
1-N-[4-naphthalen-2-yl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-1-N-(2-phenylphenyl)-4-N,4-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177074371
1-N-[4-phenyl-6-[4-(2-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-1-N-pyrimidin-4-yl-4-N,4-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177073691
1-N-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)-1-N-(3-phenylnaphthalen-2-yl)-4-N,4-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177073651
1-N-(3,5-diphenylphenyl)-1-N-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)-4-N,4-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177074340
4-N-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(1-phenylnaphthalen-2-yl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177073694
N-[4-[bis(2,4,6-trimethylphenyl)methyl]phenyl]-4-(3,5-diphenylphenyl)-6-phenyl-N-[4-(2-phenylphenyl)phenyl]-1,3,5-triazin-2-amine
CID 177073958
N-[4-bis(2,4,6-trimethylphenyl)boranylphenyl]-4-phenyl-N-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-amine
CID 177074002
1-N,1-N-bis(3,5-dideuterio-2,4,6-trimethylphenyl)-4-N,4-N-bis(4,6-diphenyl-1,3,5-triazin-2-yl)benzene-1,4-diamine
CID 177074261
1-N-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)-1-N-phenyl-3-N,3-N-bis(2,4,6-trimethylphenyl)benzene-1,3-diamine
CID 177074144
1-N-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-1-N-(1-phenylnaphthalen-2-yl)-4-N,4-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine
CID 177073725

Frequently Asked Questions

What is the IUPAC name of 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine?
The IUPAC name of 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine (CID 177073889) is 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine.
What is the SMILES notation for 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine?
The canonical SMILES for 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine is Cc1cc(C)c(N(c2ccc(N(c3nc(-c4ccccc4)nc(-c4ccc(-c5ccccc5)cc4)n3)c3nc(-c4ccccc4)nc(-c4ccccc4-c4ccccc4)n3)cc2)c2c(C)cc(C)cc2C)c(C)c1.
What is the InChIKey of 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine?
The InChIKey is BEAQRNAZNKTYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H54N8/c1-43-39-45(3)59(46(4)40-43)73(60-47(5)41-44(2)42-48(60)6)55-35-37-56(38-36-55)74(65-69-61(52-25-15-9-16-26-52)67-63(71-65)54-33-31-50(32-34-54)49-21-11-7-12-22-49)66-70-62(53-27-17-10-18-28-53)68-64(72-66)58-30-20-19-29-57(58)51-23-13-8-14-24-51/h7-42H,1-6H3.
What are the key properties of 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine?
4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine has a molecular weight of 959.21 g/mol, XLogP of 16.85, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-N-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-N,1-N-bis(2,4,6-trimethylphenyl)benzene-1,4-diamine is sourced from PubChem (CID 177073889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).