3-[[4-chloro-1-(2,3-dimethylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,4-dimethylphenyl)benzamide
Basic information
- CAS
6878-99-5- Standard SMILES
Cc1ccc(NC(=O)c2cccc(NC3=C(Cl)C(=O)N(c4cccc(C)c4C)C3=O)c2)c(C)c1- InChIKey
SFSXGWYXVIDBCB-UHFFFAOYSA-N- Molecular formula
- C27H24ClN3O3
- Average molar mass
- 473.9 g/mol
- Monoisotopic mass
- 473.1506193
Names & identifiers
- Preferred name
- 3-[[4-chloro-1-(2,3-dimethylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,4-dimethylphenyl)benzamide
- IUPAC
- 3-[[4-chloro-1-(2,3-dimethylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,4-dimethylphenyl)benzamide
Names & synonyms
6878-99-53-[[4-chloro-1-(2,3-dimethylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,4-dimethylphenyl)benzamideDTXSID203647523-{[4-Chloro-1-(2,3-dimethylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,4-dimethylphenyl)benzamide
Database identifiers
- CAS
6878-99-5- PubChem CID
- 1674337
- DTXSID
DTXSID20364752
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 843
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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