Basic information
- CAS
1036991-21-5- Standard SMILES
O=C(NCC(F)(F)F)Nc1cccc(-c2cnc3cc(-c4ccc(F)cc4)ccn23)c1- InChIKey
BCAIAJFLSCRMPZ-UHFFFAOYSA-N- Molecular formula
- C22H16F4N4O
- Average molar mass
- 428.4 g/mol
Names & identifiers
- Preferred name
- 1-{3-[7-(4-Fluoro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-phenyl}-3-(2,2,2-trifluoro-ethyl)-urea
- IUPAC
- 1-[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-3-(2,2,2-trifluoroethyl)urea
Names & synonyms
1-{3-[7-(4-Fluoro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-phenyl}-3-(2,2,2-trifluoro-ethyl)-ureaAstex FGF inhibitor(Fluorophenyl)-(FGFR)SCHEMBL3322953CHEMBL3647337BDBM139908NSC754361NSC-754361US8895745, 591036991-21-5N-{3-[7-(4-Fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl}-N'-(2,2,2-trifluoroethyl)urea hydrochlorideUrea, N-[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-N'-(2,2,2-trifluoroethyl)-, hydrochloride (1:1)
Database identifiers
- CAS
1036991-21-5- PubChem CID
- 56589626
- ChEMBL
CHEMBL3647337
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 611
Related reactions
2 records
Compound notes
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