BARBITURIC ACID, 1-(p-CHLOROPHENYL)-5,5-DIETHYL-
Basic information
- CAS
66940-50-9- Standard SMILES
CCC1(CC)C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O- InChIKey
ZSTXEPXDPBFCTC-UHFFFAOYSA-N- Molecular formula
- C14H15ClN2O3
- Average molar mass
- 294.73 g/mol
- Monoisotopic mass
- 294.07712
Names & identifiers
- Preferred name
- BARBITURIC ACID, 1-(p-CHLOROPHENYL)-5,5-DIETHYL-
- IUPAC
- 1-(4-chlorophenyl)-5,5-diethyl-1,3-diazinane-2,4,6-trione
- English name
- 1-(p-Chlorophenyl)-5,5-diethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular weight
- 0
Names & synonyms
BARBITURIC ACID, 1-(p-CHLOROPHENYL)-5,5-DIETHYL-66940-50-9BRN 02699441-(p-Chlorophenyl)-5,5-diethylbarbituric acid1-(4-chlorophenyl)-5,5-diethyl-1,3-diazinane-2,4,6-trioneDTXSID702170871-(p-Chlorophenyl)-5,5-diethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
66940-50-9- PubChem CID
- 48393
- DTXSID
DTXSID70217087- Nikkaji
- J93.599I
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 426
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Compound notes
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