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Pyrimidine, 4-amino-2,6-dibenzyl-5-phenyl-

HCID 412805
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Basic information

CAS
6307-01-3
Standard SMILES
Nc1nc(Cc2ccccc2)nc(Cc2ccccc2)c1-c1ccccc1
InChIKey
YYHHGERFHBNSHG-UHFFFAOYSA-N
Molecular formula
C24H21N3
Average molar mass
351.4 g/mol
Monoisotopic mass
351.17354768

Names & identifiers

Preferred name
Pyrimidine, 4-amino-2,6-dibenzyl-5-phenyl-
IUPAC
2,6-dibenzyl-5-phenylpyrimidin-4-amine

Names & synonyms

6307-01-3Pyrimidine, 4-amino-2,6-dibenzyl-5-phenyl-NSC 41663DTXSID10212394Pyrimidin-4-amine, 2,6-dibenzyl-5-phenyl-RefChem:177761DTXCID10134885YYHHGERFHBNSHG-UHFFFAOYSA-N2,6-dibenzyl-5-phenylpyrimidin-4-amineNSC41663NSC-416632,6-Dibenzyl-5-phenyl-4-pyrimidinamine
Show more names
Pyrimidine,4-amino-2,6-dibenzyl-5-phenyl-,NCIStruc1_001226NCIStruc2_001365Oprea1_729564CHEMBL1410759SCHEMBL15599153NCI41663CCG-36907

Database identifiers

CAS
6307-01-3
PubChem CID
412805
DTXSID
DTXSID10212394
ChEMBL
CHEMBL1410759
Nikkaji
J1.289.344B

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
51.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
27
Formal charge
0
Complexity
421

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