Ethanediamide, N-(2-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)carbonyl)phenyl)-N'-(2-methylpropyl)-
Basic information
- CAS
40528-25-4- Standard SMILES
Cc1c(NC(=O)c2ccccc2NC(=O)C(=O)NCC(C)C)c(=O)n(-c2ccccc2)n1C- InChIKey
UVDHAUJSOQXZHW-UHFFFAOYSA-N- Molecular formula
- C24H27N5O4
- Average molar mass
- 449.5 g/mol
- Monoisotopic mass
- 449.20630436
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'-(2-methylpropyl)-
- IUPAC
- N'-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]-N-(2-methylpropyl)oxamide
Names & synonyms
BRN 072950540528-25-4Ethanediamide, N-(2-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)carbonyl)phenyl)-N'-(2-methylpropyl)-RefChem:340065DTXSID60960939N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{2-[(2-methylpropyl)amino](oxo)acetamido}benzene-1-carboximidic acidN-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{2-[(2-methylpropyl)amino]-2-oxoacetamido}benzene-1-carboximidic acid
Database identifiers
- CAS
40528-25-4- PubChem CID
- 218374
- DTXSID
DTXSID60960939
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 803
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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