Ethanediamide, N-(2-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)carbonyl)phenyl)-N'-(phenylmethyl)-
Basic information
- CAS
40528-27-6- Standard SMILES
Cc1c(NC(=O)c2ccccc2NC(=O)C(=O)NCc2ccccc2)c(=O)n(-c2ccccc2)n1C- InChIKey
QJBFJNVATPKEBI-UHFFFAOYSA-N- Molecular formula
- C27H25N5O4
- Average molar mass
- 483.5 g/mol
- Monoisotopic mass
- 483.1906543
Names & identifiers
- Preferred name
- Ethanediamide, N-(2-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)carbonyl)phenyl)-N'-(phenylmethyl)-
- IUPAC
- N-benzyl-N'-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]oxamide
Names & synonyms
BRN 073328240528-27-6Ethanediamide, N-(2-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)carbonyl)phenyl)-N'-(phenylmethyl)-RefChem:340066DTXSID309609412-[2-(Benzylamino)(oxo)acetamido]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidic acid2-[2-(Benzylamino)-2-oxoacetamido]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidic acid
Database identifiers
- CAS
40528-27-6- PubChem CID
- 218376
- DTXSID
DTXSID30960941
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 875
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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