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1,5-Dibenzylpyrimidine-2,4(1H,3H)-dione

HCID 308735
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Basic information

CAS
28485-24-7
Standard SMILES
O=c1[nH]c(=O)n(Cc2ccccc2)cc1Cc1ccccc1
InChIKey
KYMKYQZROTUTKZ-UHFFFAOYSA-N
Molecular formula
C18H16N2O2
Average molar mass
292.3 g/mol
Monoisotopic mass
292.12117776

Names & identifiers

Preferred name
1,5-Dibenzylpyrimidine-2,4(1H,3H)-dione
IUPAC
1,5-dibenzylpyrimidine-2,4-dione

Names & synonyms

NSC21077928485-24-71,5-Dibenzylpyrimidine-2,4(1H,3H)-dioneCHEMBL356031DTXSID70309012NSC-210779

Database identifiers

CAS
28485-24-7
PubChem CID
308735
DTXSID
DTXSID70309012
ChEMBL
CHEMBL356031
Nikkaji
J2.450.220A

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
49.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
22
Formal charge
0
Complexity
446

Related reactions

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Compound notes

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