Basic information
- CAS
685108-35-4- Standard SMILES
O=C(Nc1cccc2[nH]ncc12)c1ccco1- InChIKey
IMPBSVNHQWUXJE-UHFFFAOYSA-N- Molecular formula
- C12H9N3O2
- Average molar mass
- 227.22 g/mol
- Monoisotopic mass
- 227.06947654
Names & identifiers
- Preferred name
- N-(1H-indazol-4-yl)furan-2-carboxamide
- IUPAC
- N-(1H-indazol-4-yl)furan-2-carboxamide
- English name
- FURAN-2-CARBOXYLIC ACID (1H-INDAZOL-4-YL)-AMIDE
- Molecular formula
- C12H9N3O2
- Molecular weight
- 227.22
Names & synonyms
N-(1H-indazol-4-yl)furan-2-carboxamide685108-35-4N-(1H-indazol-4-yl)-2-furamideMFCD03617557Bionet2_001349CHEMBL5016605HMS1367N07AKOS010265184DB-3384472-FURANCARBOXAMIDE, N-1H-INDAZOL-4-YL-10T-0070FURAN-2-CARBOXYLIC ACID (1H-INDAZOL-4-YL)-AMIDE
Database identifiers
- CAS
685108-35-4- PubChem CID
- 1482885
- ChEMBL
CHEMBL5016605
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 70.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 297
Physicochemical properties
- Boiling point
- 351 · 351.0±17.0 °C(Predicted)
- Density
- 1.449 · 1.449±0.06 g/cm3(Predicted)
- pka
- 12.37 · 12.37±0.43(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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