Basic information
- CAS
445382-26-3- Standard SMILES
CCOC(=O)Cc1[nH]nc2c1C(c1ccc(C(C)(C)C)cc1)C(C#N)=C(N)O2- InChIKey
WYOYBAUZEAFYCY-UHFFFAOYSA-N- Molecular formula
- C21H24N4O3
- Average molar mass
- 380.4 g/mol
Names & identifiers
- Preferred name
- Ethyl [6-amino-4-(4-tert-butylphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
- IUPAC
- ethyl 2-[6-amino-4-(4-tert-butylphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
- English name
- ethyl [6-amino-4-(4-tert-butylphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
- Molecular formula
- C21H24N4O3
- Molecular weight
- 380.44026
Names & synonyms
ethyl [6-amino-4-(4-tert-butylphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetateAKOS000668094AKOS016348795ethyl 2-[6-amino-4-(4-tert-butylphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetateST50027040AM-807/14146374SR-01000364586SR-01000364586-1ethyl 2-{6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-4H-pyrano[2,3-c]pyrazol-3-yl }acetate
Database identifiers
- CAS
445382-26-3
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 667
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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