Basic information
- CAS
42061-68-7- Standard SMILES
CCC1(c2ccccc2)C(=O)N(C)C(=O)N(COC)C1=O- InChIKey
HEUUPESYFVKOLK-UHFFFAOYSA-N- Molecular formula
- C15H18N2O4
- Average molar mass
- 290.31 g/mol
- Monoisotopic mass
- 290.12665706
Names & identifiers
- Preferred name
- Barbituric acid, 5-ethyl-3-(methoxymethyl)-1-methyl-5-phenyl-
- IUPAC
- 5-ethyl-1-(methoxymethyl)-3-methyl-5-phenyl-1,3-diazinane-2,4,6-trione
- English name
- 5-Ethyl-3-(methoxymethyl)-1-methyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular weight
- 0
Names & synonyms
42061-68-7BARBITURIC ACID, 5-ETHYL-3-(METHOXYMETHYL)-1-METHYL-5-PHENYL-RefChem:10776503-(Methoxymethyl)-1-methylphenobarbitalBRN 07609815-Ethyl-3-(methoxymethyl)-1-methyl-5-phenylbarbituric acid5-ethyl-1-(methoxymethyl)-3-methyl-5-phenyl-1,3-diazinane-2,4,6-trione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-(methoxymethyl)-3-methyl-5-phenyl-DTXSID209622375-Ethyl-3-(methoxymethyl)-1-methyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
42061-68-7- PubChem CID
- 39130
- DTXSID
DTXSID20962237- Nikkaji
- J105.575E
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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