Basic information
- Standard SMILES
OCc1cc(-c2ccc(Cl)cc2)nc2c(I)cnn12- InChIKey
NZPDXBCXJRUTTE-UHFFFAOYSA-N- Molecular formula
- C13H9ClIN3O
- Average molar mass
- 385.59 g/mol
Names & identifiers
- Preferred name
- [5-(4-Chloro-phenyl)-3-iodo-pyrazolo[1,5-a]pyrimidin-7-yl]-methanol
- IUPAC
- [5-(4-chlorophenyl)-3-iodopyrazolo[1,5-a]pyrimidin-7-yl]methanol
Names & synonyms
SCHEMBL1348927NZPDXBCXJRUTTE-UHFFFAOYSA-N[5-(4-chloro-phenyl)-3-iodo-pyrazolo[1,5-a]pyrimidin-7-yl]-methanol
Database identifiers
- PubChem CID
- 67001059
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 314
Related reactions
10 records
Compound notes
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