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Basic information
- Standard SMILES
CSc1ncc2cc(COC(C)=O)c(=O)n(C3CCCC3)c2n1- InChIKey
UIWNMPJDXDKUEA-UHFFFAOYSA-N- Molecular formula
- C16H19N3O3S
- Average molar mass
- 333.4 g/mol
Names & identifiers
- Preferred name
- Acetic acid 8-cyclopentyl-2-methylsulfanyl-7-oxo-7,8-dihydro-pyrido[2,3-d]pyrimidin-6-ylmethyl ester
- IUPAC
- (8-cyclopentyl-2-methylsulfanyl-7-oxopyrido[2,3-d]pyrimidin-6-yl)methyl acetate
Names & synonyms
SCHEMBL4825421UIWNMPJDXDKUEA-UHFFFAOYSA-Nacetic acid 8-cyclopentyl-2-methylsulfanyl-7-oxo-7,8-dihydro-pyrido[2,3-d]pyrimidin-6-ylmethyl ester
Database identifiers
- PubChem CID
- 11348177
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 97.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 505
Related reactions
7 records
Compound notes
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