Basic information
- Standard SMILES
COC(=O)c1c(-c2ccc(F)cc2)oc2ncc(-c3cc(C(=O)NC4(c5ccccn5)CC4)ccc3C)cc12- InChIKey
AITLIWOEBWIAMW-UHFFFAOYSA-N- Molecular formula
- C31H24FN3O4
- Average molar mass
- 521.5 g/mol
Names & identifiers
- Preferred name
- Methyl 2-(4-fluorophenyl)-5-(2-methyl-5-(1-(pyridin-2-yl)cyclopropylcarbamoyl)phenyl)furo[2,3-b]pyridine-3-carboxylate
- IUPAC
- methyl 2-(4-fluorophenyl)-5-[2-methyl-5-[(1-pyridin-2-ylcyclopropyl)carbamoyl]phenyl]furo[2,3-b]pyridine-3-carboxylate
Names & synonyms
SCHEMBL1936786AITLIWOEBWIAMW-UHFFFAOYSA-Nmethyl 2-(4-fluorophenyl)-5-(2-methyl-5-(1-(pyridin-2-yl)cyclopropylcarbamoyl)phenyl)furo[2,3-b]pyridine-3-carboxylate
Database identifiers
- PubChem CID
- 67217832
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 891
Related reactions
4 records
Compound notes
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