3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine

C24H18Br2N2O2 — CID 57342779

IUPAC3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine
SMILESCOc1ccc(-c2cncc(Br)c2-c2c(Br)cncc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H18Br2N2O2/c1-29-17-7-3-15(4-8-17)19-11-27-13-21(25)23(19)24-20(12-28-14-22(24)26)16-5-9-18(30-2)10-6-16/h3-14H,1-2H3
InChIKeyVFFYUTIPOJATLG-UHFFFAOYSA-N
MW526.23 g/mol
LogP7.02
Rot. Bonds5

About 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine

3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine (PubChem CID 57342779) has the molecular formula C24H18Br2N2O2 and a molecular weight of 526.23 g/mol. Its IUPAC name is 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine.

Molecular Properties

Compound Name3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine
PubChem CID57342779
Molecular FormulaC24H18Br2N2O2
Molecular Weight526.23 g/mol
Exact Mass523.97
IUPAC Name3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine
SMILESCOc1ccc(-c2cncc(Br)c2-c2c(Br)cncc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H18Br2N2O2/c1-29-17-7-3-15(4-8-17)19-11-27-13-21(25)23(19)24-20(12-28-14-22(24)26)16-5-9-18(30-2)10-6-16/h3-14H,1-2H3
InChIKeyVFFYUTIPOJATLG-UHFFFAOYSA-N
XLogP7.02
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.23
LogP ≤ 57.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine 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-bromo-5-(4-methoxyphenyl)pyrimidine
CID 105370920
2,6,11,15-tetrakis(4-methoxyphenyl)-4,13,19,20-tetrazatricyclo[14.2.1.17,10]icosa-1(18),2,4,6,8,10,12,14,16-nonaene
CID 101487109
4,5-bis(4-methoxyphenyl)-1H-pyridazin-6-one
CID 101246039
4-(4-methoxyphenyl)-5-methylpyridine-3-carbaldehyde
CID 11770188
5-bromo-4-(4-methoxyphenoxy)pyrimidine
CID 66317769
3-bromo-2-fluoro-6-(4-methoxyphenyl)pyridine
CID 172992709
2,3,5-tris(4-methoxyphenyl)pyridine
CID 10834626
4-[2-(4-methoxyphenyl)phenyl]pyridine
CID 173342516
4-bromo-1-(difluoromethyl)-5-(4-methoxyphenyl)pyrazole
CID 171075985
[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]methanol
CID 105423037
2,3-bis(4-methoxyphenyl)-5,6-dimethylpyrazine
CID 14100167
2,4-dichloro-5-(4-methoxyphenyl)pyrimidine
CID 19735441

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine?
The IUPAC name of 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine (CID 57342779) is 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine.
What is the SMILES notation for 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine?
The canonical SMILES for 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine is COc1ccc(-c2cncc(Br)c2-c2c(Br)cncc2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine?
The InChIKey is VFFYUTIPOJATLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18Br2N2O2/c1-29-17-7-3-15(4-8-17)19-11-27-13-21(25)23(19)24-20(12-28-14-22(24)26)16-5-9-18(30-2)10-6-16/h3-14H,1-2H3.
What are the key properties of 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine?
3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine has a molecular weight of 526.23 g/mol, XLogP of 7.02, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-[3-bromo-5-(4-methoxyphenyl)-4-pyridinyl]-5-(4-methoxyphenyl)pyridine is sourced from PubChem (CID 57342779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).