1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene

C15H15BrO3 — CID 163198275

IUPAC1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene
SMILESCOc1cc(OC)cc(-c2ccc(Br)cc2OC)c1
InChIInChI=1S/C15H15BrO3/c1-17-12-6-10(7-13(9-12)18-2)14-5-4-11(16)8-15(14)19-3/h4-9H,1-3H3
InChIKeyBVPIXTSAEHFIRU-UHFFFAOYSA-N
MW323.19 g/mol
LogP4.14
Rot. Bonds4

About 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene

1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene (PubChem CID 163198275) has the molecular formula C15H15BrO3 and a molecular weight of 323.19 g/mol. Its IUPAC name is 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene.

Molecular Properties

Compound Name1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene
PubChem CID163198275
Molecular FormulaC15H15BrO3
Molecular Weight323.19 g/mol
Exact Mass322.02
IUPAC Name1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene
SMILESCOc1cc(OC)cc(-c2ccc(Br)cc2OC)c1
InChIInChI=1S/C15H15BrO3/c1-17-12-6-10(7-13(9-12)18-2)14-5-4-11(16)8-15(14)19-3/h4-9H,1-3H3
InChIKeyBVPIXTSAEHFIRU-UHFFFAOYSA-N
XLogP4.14
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.19
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene 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-2-methoxy-1-phenylbenzene
CID 18379655
1-(4-bromophenyl)-2,4-dimethoxybenzene
CID 83666366
(5-bromo-2-methoxyphenyl)-(3,5-dimethoxyphenyl)methanamine
CID 43149051
4-bromo-1-phenyl-2-(trideuteriomethoxy)benzene
CID 171394460
4-bromo-2-(3,5-dimethoxyphenoxy)benzonitrile
CID 23431864
2,4-dibromo-1-(3-bromo-5-methoxyphenoxy)benzene
CID 132934312
1-(4-bromophenyl)-2-methoxy-4,5-dimethylbenzene
CID 83666215
4-bromo-1-ethynyl-2-methoxybenzene
CID 89397090
1-[4-(3,5-dimethoxyphenyl)phenyl]-3,5-dimethoxybenzene
CID 139197183
2,7-dibromo-4-methoxyfluoren-9-one
CID 175173621
4-(4-bromo-2-methoxyphenyl)-3-chloropyridine
CID 90079502
2-[4-(4-bromophenyl)-3-methoxyphenyl]ethanamine
CID 141163384

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene?
The IUPAC name of 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene (CID 163198275) is 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene.
What is the SMILES notation for 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene?
The canonical SMILES for 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene is COc1cc(OC)cc(-c2ccc(Br)cc2OC)c1.
What is the InChIKey of 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene?
The InChIKey is BVPIXTSAEHFIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrO3/c1-17-12-6-10(7-13(9-12)18-2)14-5-4-11(16)8-15(14)19-3/h4-9H,1-3H3.
What are the key properties of 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene?
1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene has a molecular weight of 323.19 g/mol, XLogP of 4.14, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-2-methoxyphenyl)-3,5-dimethoxybenzene is sourced from PubChem (CID 163198275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).