Basic information
- CAS
89508-66-7- Standard SMILES
Clc1cc(Cl)nc(-c2ccc(-c3ncccn3)cc2)n1- InChIKey
RNUMQZOVICGURD-UHFFFAOYSA-N- Molecular formula
- C14H8Cl2N4
- Average molar mass
- 303.1 g/mol
- Monoisotopic mass
- 302.0126017
Names & identifiers
- Preferred name
- 4,6-Dichloro-2-[4-(pyrimidin-2-yl)phenyl]pyrimidine
- IUPAC
- 4,6-dichloro-2-(4-pyrimidin-2-ylphenyl)pyrimidine
Names & synonyms
89508-66-74,6-Dichloro-2-[4-(pyrimidin-2-yl)phenyl]pyrimidineSCHEMBL10752481DTXSID40603236
Database identifiers
- CAS
89508-66-7- PubChem CID
- 20165542
- DTXSID
DTXSID40603236
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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