N'-(4-ethoxybenzoyl)-2,5-dimethylfuran-3-carbohydrazide
Basic information
- CAS
1001808-66-7- Standard SMILES
CCOc1ccc(C(=O)NNC(=O)c2cc(C)oc2C)cc1- InChIKey
VEFZMRZVQKSODG-UHFFFAOYSA-N- Molecular formula
- C16H18N2O4
- Average molar mass
- 302.32 g/mol
- Monoisotopic mass
- 302.12665706
Names & identifiers
- Preferred name
- N'-(4-ethoxybenzoyl)-2,5-dimethylfuran-3-carbohydrazide
- IUPAC
- N'-(4-ethoxybenzoyl)-2,5-dimethylfuran-3-carbohydrazide
Names & synonyms
N'-(4-ethoxybenzoyl)-2,5-dimethylfuran-3-carbohydrazideMLS001081264CHEMBL1592862DTXSID301103654HMS3001A07AKOS0079848811001808-66-7SMR000709584Z29088834
Database identifiers
- CAS
1001808-66-7- PubChem CID
- 7600558
- DTXSID
DTXSID301103654- ChEMBL
CHEMBL1592862
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Experimental & physicochemical properties
Solubility7.6 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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