Basic information
- Standard SMILES
CN1CCN(C(=O)Cn2cc(C(=O)N3CCC4(CC3)OC(=O)c3cc(F)ccc34)c3ccc(Cl)cc32)CC1- InChIKey
OCAFLBJATJPYHV-UHFFFAOYSA-N- Molecular formula
- C28H28ClFN4O4
- Average molar mass
- 539 g/mol
Names & identifiers
- Preferred name
- 1'-({6-Chloro-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-indol-3-yl}carbonyl)-5-fluoro-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one
- IUPAC
- 1'-[6-chloro-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]indole-3-carbonyl]-6-fluorospiro[2-benzofuran-3,4'-piperidine]-1-one
Names & synonyms
SCHEMBL4359819OCAFLBJATJPYHV-UHFFFAOYSA-N1'-({6-Chloro-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-indol-3-yl}carbonyl)-5-fluoro-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one
Database identifiers
- PubChem CID
- 59657640
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 75.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 938
Related reactions
3 records
Compound notes
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