Basic information
- Standard SMILES
O=C(Nc1ccc(Oc2ccnc(NC3(CO)CCCC3)n2)c2ccccc12)c1cc(F)cc(N2CCCCC2)c1- InChIKey
OICCEOXHGBJYGG-UHFFFAOYSA-N- Molecular formula
- C32H34FN5O3
- Average molar mass
- 555.6 g/mol
Names & identifiers
- Preferred name
- 3-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide
- IUPAC
- 3-fluoro-N-[4-[2-[[1-(hydroxymethyl)cyclopentyl]amino]pyrimidin-4-yl]oxynaphthalen-1-yl]-5-piperidin-1-ylbenzamide
Names & synonyms
SCHEMBL592774OICCEOXHGBJYGG-UHFFFAOYSA-N3-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide
Database identifiers
- PubChem CID
- 59553331
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 99.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 853
Related reactions
3 records
Linked notes
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