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5,5-Diethyldihydropyrimidine-2,4(1h,3h)-dione

HCID 239592
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Basic information

CAS
6299-60-1
Standard SMILES
CCC1(CC)CNC(=O)NC1=O
InChIKey
HYQROIDKNBIVDJ-UHFFFAOYSA-N
Molecular formula
C8H14N2O2
Average molar mass
170.21 g/mol
Monoisotopic mass
170.10552769

Names & identifiers

Preferred name
5,5-Diethyldihydropyrimidine-2,4(1h,3h)-dione
IUPAC
5,5-diethyl-1,3-diazinane-2,4-dione

Names & synonyms

5,5-diethyldihydropyrimidine-2,4(1h,3h)-dione6299-60-1MLS0026086665,5-diethyl-1,3-diazinane-2,4-dioneNSC44822CHEMBL1905119SCHEMBL21031966DTXSID50286332HMS3078M14NSC-44822AKOS017530326SMR001527411

Database identifiers

CAS
6299-60-1
PubChem CID
239592
DTXSID
DTXSID50286332
ChEMBL
CHEMBL1905119

Properties

Computed structural propertiesFilling in

XLogP
0.5
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
209

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