3-(Chloromethyl)-6-methyl-2-phenylpyrazolo[1,5-a]pyrimidine
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
Cc1cnc2c(CCl)c(-c3ccccc3)nn2c1- InChIKey
NXXBBCPEPYMVRI-UHFFFAOYSA-N- Molecular formula
- C14H12ClN3
- Average molar mass
- 257.72 g/mol
- Monoisotopic mass
- 257.0719751
Names & identifiers
- Preferred name
- 3-(Chloromethyl)-6-methyl-2-phenylpyrazolo[1,5-a]pyrimidine
- IUPAC
- 3-(chloromethyl)-6-methyl-2-phenylpyrazolo[1,5-a]pyrimidine
Names & synonyms
SCHEMBL5055798NXXBBCPEPYMVRI-UHFFFAOYSA-N3-(chloromethyl)-6-methyl-2-phenylpyrazolo[1,5-a]pyrimidine
Database identifiers
- PubChem CID
- 57743008
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 280
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
8 records
Compound notes
Loading…