2-(4-Chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Basic information
- CAS
65267-38-1- Standard SMILES
Clc1ccc(-c2nc3ncccn3n2)cc1- InChIKey
MRPUMSPLZXTYCU-UHFFFAOYSA-N- Molecular formula
- C11H7ClN4
- Average molar mass
- 230.65 g/mol
- Monoisotopic mass
- 230.0359239
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine
- IUPAC
- 2-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
Names & synonyms
65267-38-1NSC3016612-(4-Chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidineSCHEMBL19534096DTXSID30316287NSC-301661
Database identifiers
- CAS
65267-38-1- PubChem CID
- 327265
- DTXSID
DTXSID30316287
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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