5-[(5-Chloro-2,4-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amine

HCID 280643

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Basic information

CAS: 27845-01-8
Standard SMILES: COc1cc(OC)c(N=Nc2c(C)nc(N)nc2-c2ccccc2)cc1Cl
InChIKey: JXJBDZNYUXQHEV-UHFFFAOYSA-N
Molecular formula: C19H18ClN5O2
Average molar mass: 383.8 g/mol
Monoisotopic mass: 383.1149025

Names & identifiers

Preferred name: 5-[(5-Chloro-2,4-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amine
IUPAC: 5-[(5-chloro-2,4-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amine

Names & synonyms

27845-01-8NSC1325225-[(5-chloro-2,4-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amine5-[(e)-(5-chloro-2,4-dimethoxyphenyl)diazenyl]-4-methyl-6-phenylpyrimidin-2-amineDTXSID70299762NSC-132522

Database identifiers

CAS: 27845-01-8
PubChem CID: 280643
DTXSID: DTXSID70299762

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 95 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 7
Rotatable bonds: 5
Heavy atoms: 27
Formal charge: 0
Complexity: 491

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