Basic information
- Standard SMILES
Cl.O=c1[nH]c(=O)n(CCCCN2CCC3(CCc4cc(F)ccc43)C2)cc1-c1cccs1- InChIKey
SAIFBSPFGAOMEW-UHFFFAOYSA-N- Molecular formula
- C24H27ClFN3O2S
- Average molar mass
- 476 g/mol
- Monoisotopic mass
- 475.1496541
Names & identifiers
- Preferred name
- 1-(4-(5-Fluoro-2,3-dihydrospiro[indene-1,3'-pyrrolidine]-1'-yl)butyl)-5-(thiophen-2-yl)pyrimidine-2,4(1h,3h)-dione hydrochloride
- IUPAC
- 1-[4-(6-fluorospiro[1,2-dihydroindene-3,3'-pyrrolidine]-1'-yl)butyl]-5-thiophen-2-ylpyrimidine-2,4-dione;hydrochloride
Names & synonyms
SCHEMBL2494125SAIFBSPFGAOMEW-UHFFFAOYSA-N1-(4-(5-fluoro-2,3-dihydrospiro[indene-1,3'-pyrrolidine]-1'-yl)butyl)-5-(thiophen-2-yl)pyrimidine-2,4(1h,3h)-dione hydrochloride
Database identifiers
- PubChem CID
- 67428310
Properties
Computed structural properties
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 746
Related reactions
1 records
Compound notes
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