2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide

C15H13BrFNOS — CID 1288275

IUPAC2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide
SMILESCc1ccc(F)c(NC(=O)CSc2ccc(Br)cc2)c1
InChIInChI=1S/C15H13BrFNOS/c1-10-2-7-13(17)14(8-10)18-15(19)9-20-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,19)
InChIKeyFFGYPPJFMVDLEP-UHFFFAOYSA-N
MW354.24 g/mol
LogP4.63
Rot. Bonds4

About 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide

2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide (PubChem CID 1288275) has the molecular formula C15H13BrFNOS and a molecular weight of 354.24 g/mol. Its IUPAC name is 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide
PubChem CID1288275
Molecular FormulaC15H13BrFNOS
Molecular Weight354.24 g/mol
Exact Mass352.99
IUPAC Name2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide
SMILESCc1ccc(F)c(NC(=O)CSc2ccc(Br)cc2)c1
InChIInChI=1S/C15H13BrFNOS/c1-10-2-7-13(17)14(8-10)18-15(19)9-20-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,19)
InChIKeyFFGYPPJFMVDLEP-UHFFFAOYSA-N
XLogP4.63
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.24
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide 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-(3-methylphenyl)-2-[(4-methylphenyl)sulfanyl]acetamide
CID 788759
N-(2-bromophenyl)-3-(phenylthio)propanamide
CID 875277
2-[(2-bromobenzyl)thio]-N-phenylacetamide
CID 875433
2-[(4-fluorobenzyl)sulfanyl]-N-phenylacetamide
CID 573187
3-(4-bromophenyl)sulfonyl-N-[4-(diethylamino)-2-methylphenyl]propanamide
CID 4109100
N-(2-bromophenyl)-2-[(4-fluorophenyl)sulfanyl]acetamide
CID 720565
N-(3,5-dimethylphenyl)-2-phenylsulfanylacetamide
CID 846446
N-(4-bromophenyl)-2-((4-fluorophenyl)thio)acetamide
CID 893673
N-(4-bromo-2-methylphenyl)-3-(phenylsulfanyl)propanamide
CID 1252378
N-(4-bromophenyl)-3-[(4-methylphenyl)sulfonyl]propanamide
CID 1303359
N-(4-bromo-3-methylphenyl)-3-(phenylthio)propanamide
CID 1338487
2-[(4-bromobenzyl)thio]-N-[2-(methylthio)phenyl]acetamide
CID 2301837

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide?
The IUPAC name of 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide (CID 1288275) is 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide?
The canonical SMILES for 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide is Cc1ccc(F)c(NC(=O)CSc2ccc(Br)cc2)c1.
What is the InChIKey of 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide?
The InChIKey is FFGYPPJFMVDLEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNOS/c1-10-2-7-13(17)14(8-10)18-15(19)9-20-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide?
2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide has a molecular weight of 354.24 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)sulfanyl-N-(2-fluoro-5-methylphenyl)acetamide is sourced from PubChem (CID 1288275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).