2-(2-Carbomethoxyphenylamino)-4-phenyl-6-(4-phenoxyphenyl)pyrimidine
Basic information
- Standard SMILES
COC(=O)c1ccccc1Nc1nc(-c2ccccc2)cc(-c2ccc(Oc3ccccc3)cc2)n1- InChIKey
JMGBAYVRYXIYQR-UHFFFAOYSA-N- Molecular formula
- C30H23N3O3
- Average molar mass
- 473.5 g/mol
- Monoisotopic mass
- 473.1739416
Names & identifiers
- Preferred name
- 2-(2-Carbomethoxyphenylamino)-4-phenyl-6-(4-phenoxyphenyl)pyrimidine
- IUPAC
- methyl 2-[[4-(4-phenoxyphenyl)-6-phenylpyrimidin-2-yl]amino]benzoate
Names & synonyms
JMGBAYVRYXIYQR-UHFFFAOYSA-NDTXSID9013548912-(2-Carbomethoxyphenylamino)-4-phenyl-6-(4-phenoxyphenyl)pyrimidineQ63409103Methyl 2-([4-(4-phenoxyphenyl)-6-phenyl-2-pyrimidinyl]amino)benzoate #Methyl 2-{[4-(4-phenoxyphenyl)-6-phenyl-2-pyrimidinyl]amino}benzoate2-(4-(4-PHENOXYPHENYL)-6-PHENYL-2-PYRIMIDINYLAMINO)BENZOIC ACID METHYL ESTER
Database identifiers
- PubChem CID
- 634432
- DTXSID
DTXSID901354891- Nikkaji
- J183.729J
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 73.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 670
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Compound notes
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