Basic information
- Standard SMILES
Nc1nc(N)c2cc(CO)cnc2n1- InChIKey
PLCOCYHGWKGYKS-UHFFFAOYSA-N- Molecular formula
- C8H9N5O
- Average molar mass
- 191.19 g/mol
Names & identifiers
- Preferred name
- 2,4-Diamino-6-(hydroxymethyl)pyrido[2,3-d]pyrimidine
- IUPAC
- (2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methanol
Names & synonyms
2,4-Diamino-6-(hydroxymethyl)pyrido[2,3-d]pyrimidine(2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methanolCHEMBL80347SCHEMBL6307127PLCOCYHGWKGYKS-UHFFFAOYSA-N2,4-diaminopyrido [2,3-d]pyrimidine-6-methanol(2,4-Diaminopyridino[2,3-d]pyrimidin-6-yl)methan-1-ol
Database identifiers
- PubChem CID
- 487416
- ChEMBL
CHEMBL80347- Nikkaji
- J1.577.475D
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Related reactions
8 records
Compound notes
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