Basic information
- CAS
27512-03-4- Standard SMILES
CCOCN1C(=O)N(COCC)C(=O)C(CC)(c2ccccc2)C1=O- InChIKey
INJMAFDBGNBDKD-UHFFFAOYSA-N- Molecular formula
- C18H24N2O5
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.16852187
Names & identifiers
- Preferred name
- Barbituric acid, 1,3-bis(ethoxymethyl)-5-ethyl-5-phenyl-
- IUPAC
- 1,3-bis(ethoxymethyl)-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione
Names & synonyms
BARBITURIC ACID, 1,3-BIS(ETHOXYMETHYL)-5-ETHYL-5-PHENYL-27512-03-4DTXSID30181937RefChem:1077470DTXCID70104428BRN 06287781,3-Bis(ethoxymethyl)-5-ethyl-5-phenylbarbituric acid1,3-bis(ethoxymethyl)-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione
Database identifiers
- CAS
27512-03-4- PubChem CID
- 33926
- DTXSID
DTXSID30181937
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 472
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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