6-Amino-4-[5-(4-fluorophenyl)pyridin-3-yl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
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Basic information
- CAS
665001-04-7- Standard SMILES
CCCc1[nH]nc2c1C(c1cncc(-c3ccc(F)cc3)c1)C(C#N)=C(N)O2- InChIKey
VKBNMHICUUGVTF-UHFFFAOYSA-N- Molecular formula
- C21H18FN5O
- Average molar mass
- 375.4 g/mol
- Monoisotopic mass
- 375.14953838
Names & identifiers
- Preferred name
- 6-Amino-4-[5-(4-fluorophenyl)pyridin-3-yl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
- IUPAC
- 6-amino-4-[5-(4-fluorophenyl)-3-pyridinyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
- English name
- 6-amino-4-[5-(4-fluorophenyl)-3-pyridinyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
- Molecular formula
- C21H18FN5O
- Molecular weight
- 375.3989232
Names & synonyms
6-amino-4-[5-(4-fluorophenyl)pyridin-3-yl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile6-amino-4-[5-(4-fluorophenyl)-3-pyridinyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrileZINC00971518AM-807/42004109665001-04-7
Database identifiers
- CAS
665001-04-7- PubChem CID
- 4385299
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 638
Related reactions
0 records
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Compound notes
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