Basic information
- Standard SMILES
Cl.O=c1[nH]c(=O)n(CCCN2CCC3(CCc4cc(F)ccc43)C2)cc1-c1cccs1- InChIKey
POSQXZMVTOMMTH-UHFFFAOYSA-N- Molecular formula
- C23H25ClFN3O2S
- Average molar mass
- 462 g/mol
Names & identifiers
- Preferred name
- 1-(3-(5-Fluoro-2,3-dihydrospiro[indene-1,3'-pyrrolidine]-1'-yl)propyl)-5-(thiophen-2-yl)pyrimidine-2,4(1h,3h)-dione hydrochloride
- IUPAC
- 1-[3-(6-fluorospiro[1,2-dihydroindene-3,3'-pyrrolidine]-1'-yl)propyl]-5-thiophen-2-ylpyrimidine-2,4-dione;hydrochloride
Names & synonyms
SCHEMBL2496289POSQXZMVTOMMTH-UHFFFAOYSA-N1-(3-(5-fluoro-2,3-dihydrospiro[indene-1,3'-pyrrolidine]-1'-yl)propyl)-5-(thiophen-2-yl)pyrimidine-2,4(1h,3h)-dione hydrochloride
Database identifiers
- PubChem CID
- 67429035
Properties
Computed structural properties
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 731
Related reactions
1 records
Compound notes
Loading…