EO-1428
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Basic information
- CAS
321351-00-2- Standard SMILES
Cc1ccccc1C(=O)c1ccc(Nc2ccc(Br)cc2N)cc1Cl- InChIKey
HDCLCHNAEZNGNV-UHFFFAOYSA-N- Molecular formula
- C20H16BrClN2O
- Average molar mass
- 415.7 g/mol
- Monoisotopic mass
- 414.01345
Overview
[4-(2-amino-4-bromoanilino)-2-chlorophenyl]-(2-methylphenyl)methanone is a member of benzophenones.
Names & identifiers
- Preferred name
- EO-1428
- IUPAC
- [4-(2-amino-4-bromoanilino)-2-chlorophenyl]-(2-methylphenyl)methanone
- English name
- EO 1428
- Molecular formula
- C20H16BrClN2O
- Molecular weight
- 415.71
Names & synonyms
321351-00-2EO-1428UNII-MV2RHJ680OMV2RHJ680O(4-((2-Amino-4-bromophenyl)amino)-2-chlorophenyl)(2-methylphenyl)methanoneMethanone, (4-((2-amino-4-bromophenyl)amino)-2-chlorophenyl)(2-methylphenyl)-DTXSID70185914[4-[(2-Amino-4-bromophenyl)amino]-2-chlorophenyl](2-methylphenyl)methanone{4-[(2-amino-4-bromophenyl)amino]-2-chlorophenyl}(2-methylphenyl)methanoneRefChem:137070DTXCID10108405EO 1428
Show more names
p38 MAP Kinase Inhibitor VIII(2-Methylphenyl)-[4-[(2-amino-4-bromophenyl)amino]-2-chlorophenyl]methanoneMethanone, [4-[(2-amino-4-bromophenyl)amino]-2-chlorophenyl](2-methylphenyl)-
p38 MAPK Inhibitor VIII[4-(2-amino-4-bromoanilino)-2-chlorophenyl]-(2-methylphenyl)methanoneCHEMBL347496(4-((2-Amino-4-bromophenyl)amino)-2-chlorophenyl)(o-tolyl)methanone479543-48-1HDCLCHNAEZNGNV-UHFFFAOYSA-NC20H16BrClN2OSCHEMBL745376
Database identifiers
- CAS
321351-00-2- PubChem CID
- 9801969
- DTXSID
DTXSID70185914- ChEMBL
CHEMBL347496- ChEBI
CHEBI:91468- UNII
- MV2RHJ680O
Properties
Computed structural propertiesFilling in
- XLogP
- 5.8
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 463
Physicochemical properties
- storage temp.
- 4 °C · Store at +4°C
- solubility
- 100 mM · Soluble to 100 mM in DMSO and to 50 mM in ethanol
- form
- Powder
- color
- yellow
- InChI
- 1S/C20H16BrClN2O/c1-12-4-2-3-5-15(12)20(25)16-8-7-14(11-17(16)22)24-19-9-6-13(21)10-18(19)23/h2-11,24H,23H2,1H3
- InChIKey
- HDCLCHNAEZNGNV-UHFFFAOYSA-N
- SMILES
- Brc1cc(c(cc1)Nc2cc(c(cc2)C(=O)c3c(cccc3)C)Cl)N
- FDA UNII
- 2 RHJ680O · MV2RHJ680O
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- WGK Germany
- 1 · WGK 1
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- WGK 1
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesEO 1428 is a p38 MAP kinase inhibitor with high antiinflammatory activity.
Additional notes
DefinitionChEBI: [4-(2-amino-4-bromoanilino)-2-chlorophenyl]-(2-methylphenyl)methanone is a member of benzophenones.
Related reactions
4 records
Compound notes
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