(3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone

C15H11BrF2O — CID 79732183

IUPAC(3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone
SMILESCc1cc(C(=O)c2cccc(Br)c2C)c(F)cc1F
InChIInChI=1S/C15H11BrF2O/c1-8-6-11(14(18)7-13(8)17)15(19)10-4-3-5-12(16)9(10)2/h3-7H,1-2H3
InChIKeyXRAVJZBWSUQDSQ-UHFFFAOYSA-N
MW325.15 g/mol
LogP4.58
Rot. Bonds2

About (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone

(3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone (PubChem CID 79732183) has the molecular formula C15H11BrF2O and a molecular weight of 325.15 g/mol. Its IUPAC name is (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone.

Molecular Properties

Compound Name(3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone
PubChem CID79732183
Molecular FormulaC15H11BrF2O
Molecular Weight325.15 g/mol
Exact Mass324.00
IUPAC Name(3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone
SMILESCc1cc(C(=O)c2cccc(Br)c2C)c(F)cc1F
InChIInChI=1S/C15H11BrF2O/c1-8-6-11(14(18)7-13(8)17)15(19)10-4-3-5-12(16)9(10)2/h3-7H,1-2H3
InChIKeyXRAVJZBWSUQDSQ-UHFFFAOYSA-N
XLogP4.58
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.15
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone 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-chloro-2-fluorophenyl)-(3-bromo-2-methylphenyl)methanone
CID 105398350
(3-bromo-2-methylphenyl)-(2,3-difluorophenyl)methanone
CID 114973529
(3-bromo-2-methylphenyl)-(2,3,4-trifluorophenyl)methanone
CID 114971667
(2-amino-5-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone
CID 79733206
(2,4-difluoro-5-methylphenyl)-(2,4-difluorophenyl)methanone
CID 79731832
(2,4-difluoro-5-methylphenyl)-(2,3,4-trifluorophenyl)methanone
CID 79749848
(5-amino-2,4-dimethylphenyl)-(2,4-difluoro-5-methylphenyl)methanone
CID 102707053
(4-bromo-5-methylthiophen-2-yl)-(2,4-difluoro-5-methylphenyl)methanone
CID 102826513
2-bromo-4-fluoro-5-methylbenzamide
CID 131582369
(3-bromo-2-fluorophenyl)-(2,3-difluoro-4-methylphenyl)methanone
CID 114020633
(3-bromo-2-fluorophenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanone
CID 107949862
N-(3-bromo-2-pyridinyl)-2,4-difluoro-5-methylbenzamide
CID 112696541

Frequently Asked Questions

What is the IUPAC name of (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone?
The IUPAC name of (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone (CID 79732183) is (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone.
What is the SMILES notation for (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone?
The canonical SMILES for (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone is Cc1cc(C(=O)c2cccc(Br)c2C)c(F)cc1F.
What is the InChIKey of (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone?
The InChIKey is XRAVJZBWSUQDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrF2O/c1-8-6-11(14(18)7-13(8)17)15(19)10-4-3-5-12(16)9(10)2/h3-7H,1-2H3.
What are the key properties of (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone?
(3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone has a molecular weight of 325.15 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-2-methylphenyl)-(2,4-difluoro-5-methylphenyl)methanone is sourced from PubChem (CID 79732183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).