4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide

C14H10BrCl2NO — CID 113445906

IUPAC4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide
SMILESCc1cc(Cl)c(NC(=O)c2ccc(Br)cc2)cc1Cl
InChIInChI=1S/C14H10BrCl2NO/c1-8-6-12(17)13(7-11(8)16)18-14(19)9-2-4-10(15)5-3-9/h2-7H,1H3,(H,18,19)
InChIKeyOYEGURPFDXSFAL-UHFFFAOYSA-N
MW359.05 g/mol
LogP5.32
Rot. Bonds2

About 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide

4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide (PubChem CID 113445906) has the molecular formula C14H10BrCl2NO and a molecular weight of 359.05 g/mol. Its IUPAC name is 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide
PubChem CID113445906
Molecular FormulaC14H10BrCl2NO
Molecular Weight359.05 g/mol
Exact Mass356.93
IUPAC Name4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide
SMILESCc1cc(Cl)c(NC(=O)c2ccc(Br)cc2)cc1Cl
InChIInChI=1S/C14H10BrCl2NO/c1-8-6-12(17)13(7-11(8)16)18-14(19)9-2-4-10(15)5-3-9/h2-7H,1H3,(H,18,19)
InChIKeyOYEGURPFDXSFAL-UHFFFAOYSA-N
XLogP5.32
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.05
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide 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

N-(2,5-dichloro-4-methylphenyl)benzamide
CID 115761007
4-amino-N-(2,5-dichloro-4-methylphenyl)-3-methylbenzamide
CID 104725697
4-bromo-N-(4-bromo-2-chlorophenyl)benzamide
CID 7924398
N-(2,5-dichloro-4-methylphenyl)-3-methyl-4-(methylamino)benzamide
CID 104728160
N-(2,5-dichloro-4-methylphenyl)-4-hydrazinyl-3-methylbenzamide
CID 104728259
4-bromo-N-(2,5-dichlorophenyl)benzamide
CID 763593
4-bromo-N-(2-chloro-4-iodophenyl)benzamide
CID 47183104
4-bromo-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 64786775
N-(2,5-dichloro-4-methylphenyl)-6-fluoropyridine-3-carboxamide
CID 115761018
3-amino-N-(2,5-dichloro-4-methylphenyl)-4-fluorobenzamide
CID 104725727
N-(2-bromo-5-chloro-4-methylphenyl)pyridine-4-carboxamide
CID 104723857
4-(aminomethyl)-N-(2-bromo-5-chloro-4-methylphenyl)benzamide
CID 104723637

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide?
The IUPAC name of 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide (CID 113445906) is 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide.
What is the SMILES notation for 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide?
The canonical SMILES for 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide is Cc1cc(Cl)c(NC(=O)c2ccc(Br)cc2)cc1Cl.
What is the InChIKey of 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide?
The InChIKey is OYEGURPFDXSFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2NO/c1-8-6-12(17)13(7-11(8)16)18-14(19)9-2-4-10(15)5-3-9/h2-7H,1H3,(H,18,19).
What are the key properties of 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide?
4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide has a molecular weight of 359.05 g/mol, XLogP of 5.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2,5-dichloro-4-methylphenyl)benzamide is sourced from PubChem (CID 113445906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).