2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine

C25H23N3 — CID 134252344

IUPAC2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
SMILESCC(C)(C)c1nc(-c2ccccc2)nc(-c2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C25H23N3/c1-25(2,3)24-27-22(20-12-8-5-9-13-20)26-23(28-24)21-16-14-19(15-17-21)18-10-6-4-7-11-18/h4-17H,1-3H3
InChIKeyIBCICEPBQQIGGW-UHFFFAOYSA-N
MW365.48 g/mol
LogP6.17
Rot. Bonds3

About 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine

2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 134252344) has the molecular formula C25H23N3 and a molecular weight of 365.48 g/mol. Its IUPAC name is 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
PubChem CID134252344
Molecular FormulaC25H23N3
Molecular Weight365.48 g/mol
Exact Mass365.19
IUPAC Name2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
SMILESCC(C)(C)c1nc(-c2ccccc2)nc(-c2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C25H23N3/c1-25(2,3)24-27-22(20-12-8-5-9-13-20)26-23(28-24)21-16-14-19(15-17-21)18-10-6-4-7-11-18/h4-17H,1-3H3
InChIKeyIBCICEPBQQIGGW-UHFFFAOYSA-N
XLogP6.17
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.48
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine 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

2-tert-butyl-4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 176647044
2-tert-butyl-4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 168803489
2,4-ditert-butyl-6-[3-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-1,3,5-triazine
CID 176843132
2-tert-butyl-4-chloro-6-(4-phenylphenyl)-1,3,5-triazine
CID 156828221
2-tert-butyl-4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazine
CID 164819251
2-tert-butyl-4-phenyl-6-(7-phenylphenanthren-2-yl)-1,3,5-triazine
CID 168803765
2-(4-tert-butylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 134252303
2-tert-butyl-4-phenanthren-3-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 176627416
2-tert-butyl-4-(3,5-diphenylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 177113619
2,4-ditert-butyl-6-[3-(4-tert-butyl-6-phenyl-1,3,5-triazin-2-yl)-5-[4-(4-fluorophenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-1,3,5-triazine
CID 176842898
2-tert-butyl-4-[3-[4-[3-(4-tert-butyl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-(4-fluorophenyl)-1,3,5-triazine
CID 176842919
2-tert-butyl-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine
CID 176627975

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine (CID 134252344) is 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine is CC(C)(C)c1nc(-c2ccccc2)nc(-c2ccc(-c3ccccc3)cc2)n1.
What is the InChIKey of 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
The InChIKey is IBCICEPBQQIGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3/c1-25(2,3)24-27-22(20-12-8-5-9-13-20)26-23(28-24)21-16-14-19(15-17-21)18-10-6-4-7-11-18/h4-17H,1-3H3.
What are the key properties of 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine has a molecular weight of 365.48 g/mol, XLogP of 6.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 134252344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).