Basic information
- CAS
27844-99-1- Standard SMILES
COc1cc(N=Nc2c(C)nc(N)nc2-c2ccccc2)c(OC)cc1Cl- InChIKey
BSBUYVHTUVJPJF-UHFFFAOYSA-N- Molecular formula
- C19H18ClN5O2
- Average molar mass
- 383.8 g/mol
- Monoisotopic mass
- 383.1149025
Names & identifiers
- Preferred name
- 5-[(e)-(4-Chloro-2,5-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amine
- IUPAC
- 5-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amine
Names & synonyms
27844-99-15-[(e)-(4-chloro-2,5-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amineNSC132523DTXSID30299763NSC-132523
Database identifiers
- CAS
27844-99-1- PubChem CID
- 280644
- DTXSID
DTXSID30299763
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 95 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 491
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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