Basic information
- Standard SMILES
O=C(O)c1cnn2cc(OCc3ccccc3)cnc12- InChIKey
JMLBPVQSGMQBAF-UHFFFAOYSA-N- Molecular formula
- C14H11N3O3
- Average molar mass
- 269.25 g/mol
Names & identifiers
- Preferred name
- 6-(Benzyloxy)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
- IUPAC
- 6-phenylmethoxypyrazolo[1,5-a]pyrimidine-3-carboxylic acid
Names & synonyms
6-(Benzyloxy)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid1356016-72-2SCHEMBL358277JMLBPVQSGMQBAF-UHFFFAOYSA-NMFCD23162850DB-129423F51249F5290046-(Benzyloxy)pyrazolo[1,5-a]pyrimidine-3-carboxylicacid6-benzyloxy-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid6-benzyloxypyrazolo[1,5-a]pyrimidine-3-carboxylic acid6-phenylmethoxypyrazolo[1,5-a]pyrimidine-3-carboxylic acid
Database identifiers
- PubChem CID
- 58056331
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
Related reactions
1 records
Compound notes
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