m-Isophthalotoluidide, 4-hydroxy-
Basic information
- CAS
29277-49-4- Standard SMILES
Cc1cccc(NC(=O)c2ccc(O)c(C(=O)Nc3cccc(C)c3)c2)c1- InChIKey
PAINAUSHDJWLKF-UHFFFAOYSA-N- Molecular formula
- C22H20N2O3
- Average molar mass
- 360.4 g/mol
- Monoisotopic mass
- 360.1473925
Names & identifiers
- Preferred name
- m-Isophthalotoluidide, 4-hydroxy-
- IUPAC
- 4-hydroxy-1-N,3-N-bis(3-methylphenyl)benzene-1,3-dicarboxamide
Names & synonyms
m-Isophthalotoluidide, 4-hydroxy-29277-49-44-Hydroxy-m-isophthalotoluidideDTXSID00183524RefChem:351564DTXCID401060154-hydroxy-1-N,3-N-bis(3-methylphenyl)benzene-1,3-dicarboxamideorb1985612AKOS040753064T333984-Hydroxy-N~1~,N~3~-bis(3-methylphenyl)benzene-1,3-dicarboxamide
Database identifiers
- CAS
29277-49-4- PubChem CID
- 207172
- DTXSID
DTXSID00183524
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 524
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Compound notes
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