Basic information
- Standard SMILES
Cc1ccnc(F)c1-c1ccc2c(c1)[C@@]1(COC(N)=N1)c1cc(C3=CCOCC3)ncc1O2- InChIKey
FRSHZPLDWPFBKY-VWLOTQADSA-N- Molecular formula
- C25H21FN4O3
- Average molar mass
- 444.5 g/mol
Names & identifiers
- Preferred name
- (S)-3-(3,6-dihydro-2H-pyran-4-yl)-7-(2-fluoro-4-methylpyridin-3-yl)-5'H-spiro[chromeno[2,3-c]pyridine-5,4'-oxazol]-2'-amine
- IUPAC
- (4S)-3'-(3,6-dihydro-2H-pyran-4-yl)-7'-(2-fluoro-4-methyl-3-pyridinyl)spiro[5H-1,3-oxazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
Names & synonyms
SCHEMBL2381971FRSHZPLDWPFBKY-VWLOTQADSA-N(S)-3-(3,6-dihydro-2H-pyran-4-yl)-7-(2-fluoro-4-methylpyridin-3-yl)-5'H-spiro[chromeno[2,3-c]pyridine-5,4'-oxazol]-2'-amine
Database identifiers
- PubChem CID
- 53464446
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 809
Related reactions
1 records
Compound notes
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