4-(3,5-Dimethylpyrazol-1-yl)-6-(4-methylpiperazin-1-yl)pyrimidine
Basic information
- CAS
52476-70-7- Standard SMILES
Cc1cc(C)n(-c2cc(N3CCN(C)CC3)ncn2)n1- InChIKey
OAORQDGTRWJPNE-UHFFFAOYSA-N- Molecular formula
- C14H20N6
- Average molar mass
- 272.35 g/mol
- Monoisotopic mass
- 272.17494466
Names & identifiers
- Preferred name
- 4-(3,5-Dimethylpyrazol-1-yl)-6-(4-methylpiperazin-1-yl)pyrimidine
- IUPAC
- 4-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperazin-1-yl)pyrimidine
Names & synonyms
52476-70-7NSC2704094-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperazin-1-yl)pyrimidineDTXSID90313459NSC-2704094-(3,5-Dimethyl-1H-pyrazol-1-yl)-6-(4-methylpiperazin-1-yl)pyrimidine
Database identifiers
- CAS
52476-70-7- PubChem CID
- 321076
- DTXSID
DTXSID90313459
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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