4-[[4-(1,1-Dimethylethyl)benzoyl]amino]benzoic acid 2-[[4-(diethylamino)phenyl]methylene]hydrazide
Basic information
- CAS
596844-38-1- Standard SMILES
CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1- InChIKey
QPXQOOYOMZPSHM-UHFFFAOYSA-N- Molecular formula
- C29H34N4O2
- Average molar mass
- 470.6 g/mol
- Monoisotopic mass
- 470.26817634
Names & identifiers
- Preferred name
- 4-[[4-(1,1-Dimethylethyl)benzoyl]amino]benzoic acid 2-[[4-(diethylamino)phenyl]methylene]hydrazide
- IUPAC
- 4-tert-butyl-N-[4-[[[4-(diethylamino)phenyl]methylideneamino]carbamoyl]phenyl]benzamide
Names & synonyms
DTXSID6011151174-[[4-(1,1-Dimethylethyl)benzoyl]amino]benzoic acid 2-[[4-(diethylamino)phenyl]methylene]hydrazide596844-38-14-tert-Butyl-N-[4-(2-{[4-(diethylamino)phenyl]methylidene}hydrazinecarbonyl)phenyl]benzamide
Database identifiers
- CAS
596844-38-1- PubChem CID
- 3364264
- DTXSID
DTXSID601115117
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 688
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Compound notes
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