Basic information
- CAS
495401-67-7- Standard SMILES
Cc1cc(Oc2cc(-n3nc(C)c(C#N)c3N)nc(-c3ccccc3)n2)cc(C)c1Cl- InChIKey
SRGLPOQPGOUCAG-UHFFFAOYSA-N- Molecular formula
- C23H19ClN6O
- Average molar mass
- 430.9 g/mol
Names & identifiers
- Preferred name
- 5-Amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-phenylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile
- IUPAC
- 5-amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-phenylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile
- English name
- 5-amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-phenyl-4-pyrimidinyl]-3-methyl-1H-pyrazole-4-carbonitrile
- Molecular formula
- C23H19ClN6O
- Molecular weight
- 430.88956
Names & synonyms
5-amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-phenyl-4-pyrimidinyl]-3-methyl-1H-pyrazole-4-carbonitrileAP-501/410016395-amino-1-[6-(4-chloro-3,5-dimethylphenoxy)-2-phenylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile
Database identifiers
- CAS
495401-67-7
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 639
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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