Basic information
- Standard SMILES
COc1ccc(-c2ccc3c(=O)[nH]c(=O)[nH]c3n2)cc1COC(=O)C(C)(C)C- InChIKey
YLFUFJAKJYIFNZ-UHFFFAOYSA-N- Molecular formula
- C20H21N3O5
- Average molar mass
- 383.4 g/mol
Names & identifiers
- Preferred name
- 5-(2,4-Dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-7-yl)-2-methoxybenzyl pivalate
- IUPAC
- [5-(2,4-dioxo-1H-pyrido[2,3-d]pyrimidin-7-yl)-2-methoxyphenyl]methyl 2,2-dimethylpropanoate
Names & synonyms
SCHEMBL1558146YLFUFJAKJYIFNZ-UHFFFAOYSA-N5-(2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-7-yl)-2-methoxybenzyl pivalate
Database identifiers
- PubChem CID
- 44554229
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 617
Related reactions
1 records
Compound notes
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