Basic information
- Standard SMILES
CC(=O)c1c(C)c2cnc(Nc3ccc(N4CCCCC4)cn3)nc2n(C2CCCC2)c1=O- InChIKey
HOSSGPJLIMSTBP-UHFFFAOYSA-N- Molecular formula
- C25H30N6O2
- Average molar mass
- 446.5 g/mol
Names & identifiers
- Preferred name
- Pyrido-[2,3-d]-pyrimidin-7-one 58
- IUPAC
- 6-acetyl-8-cyclopentyl-5-methyl-2-[(5-piperidin-1-yl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one
Names & synonyms
Pyrido-[2,3-d]-pyrimidin-7-one 58BDBM6324CHEMBL193167SCHEMBL4833113SCHEMBL30176555HOSSGPJLIMSTBP-UHFFFAOYSA-N6-Acetyl-8-cyclopentyl-5-methyl-2-(3,4,5,6-tetrahydro-2H-[1,3 ]bipyridinyl-6 -ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one6-Acetyl-8-cyclopentyl-5-methyl-2-(3,4,5,6-tetrahydro-2H-[1,3']bipyridinyl-6'-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one8-cyclopentyl-6-acetyl-5-methyl-2-{[5-(piperidin-1-yl)pyridin-2-yl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
Database identifiers
- PubChem CID
- 5330301
- ChEMBL
CHEMBL193167
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 773
Related reactions
4 records
Compound notes
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