3-(4-Chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
Basic information
- CAS
58347-53-8- Standard SMILES
Cc1cc(=O)n2[nH]cc(-c3ccc(Cl)cc3)c2n1- InChIKey
BBVYTPDJKBELJW-UHFFFAOYSA-N- Molecular formula
- C13H10ClN3O
- Average molar mass
- 259.69 g/mol
- Monoisotopic mass
- 259.0512396
Names & identifiers
- Preferred name
- 3-(4-Chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
- IUPAC
- 3-(4-chlorophenyl)-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
Names & synonyms
3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol58347-53-83-(4-chlorophenyl)-5-methyl-4H,7H-pyrazolo[1,5-a]pyrimidin-7-oneCHEMBL4911953-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one77493-80-23-(4-chlorophenyl)-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-oneDTXSID301201452BDBM50263873SBB081461STK191730STK592774
Show more names
AKOS000276412AKOS000550758CCG-114949ST062551SR-01000366259SR-01000366259-1F3348-0323Z431529970
Database identifiers
- CAS
58347-53-8- PubChem CID
- 754772
- DTXSID
DTXSID301201452- ChEMBL
CHEMBL491195
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 473
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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