N,N'-Bis(4,5-dichloro-2-methylphenyl)isophthalamide
Basic information
- CAS
6676-76-2- Standard SMILES
Cc1cc(Cl)c(Cl)cc1NC(=O)c1cccc(C(=O)Nc2cc(Cl)c(Cl)cc2C)c1- InChIKey
FOWSDJPDGBMFHV-UHFFFAOYSA-N- Molecular formula
- C22H16Cl4N2O2
- Average molar mass
- 482.2 g/mol
- Monoisotopic mass
- 479.996589
Names & identifiers
- Preferred name
- N,N'-Bis(4,5-dichloro-2-methylphenyl)isophthalamide
- IUPAC
- 1-N,3-N-bis(4,5-dichloro-2-methylphenyl)benzene-1,3-dicarboxamide
Names & synonyms
NSC-2042316676-76-2NSC204231CHEMBL1165290DTXSID50308462N,N'-BIS(4,5-DICHLORO-2-METHYLPHENYL)ISOPHTHALAMIDEAKOS024434295N1,5-dichloro-2-methylphenyl)isophthalamideN~1~,N~3~-Bis(4,5-dichloro-2-methylphenyl)benzene-1,3-dicarboxamide
Database identifiers
- CAS
6676-76-2- PubChem CID
- 306547
- DTXSID
DTXSID50308462- ChEMBL
CHEMBL1165290
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 572
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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