Basic information
- CAS
26371-47-1- Standard SMILES
O=C1NC(=O)C(Cc2ccccc2)(Cc2ccccc2)C(=O)N1- InChIKey
SLCFHAGEVYERLB-UHFFFAOYSA-N- Molecular formula
- C18H16N2O3
- Average molar mass
- 308.3 g/mol
- Monoisotopic mass
- 308.11609238
Names & identifiers
- Preferred name
- 5,5-Dibenzyl-barbituric acid
- IUPAC
- 5,5-dibenzyl-1,3-diazinane-2,4,6-trione
- English name
- 5,5-Dibenzylbarbituric acid
- Molecular formula
- C18H16N2O3
- Molecular weight
- 308.33
Names & synonyms
26371-47-1BARBITURIC ACID, 5,5-DIBENZYL-5,5-Dibenzyl-barbituric acidD573F0T1Z0NSC-109107DTXSID00180972RefChem:1072125DTXCID401034635,5-Dibenzylbarbituric acidMLS0027041215,5-dibenzyl-1,3-diazinane-2,4,6-trioneNSC 109107
Show more names
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-bis(phenylmethyl)-
BRN 0284477DibenzylbarbitursaureNSC109107Barbituric acid,5-dibenzyl-Oprea1_3369695-24-09-00362 (Beilstein Handbook Reference)UNII-D573F0T1Z0SCHEMBL5448618
Database identifiers
- CAS
26371-47-1- PubChem CID
- 33496
- DTXSID
DTXSID00180972- ChEMBL
CHEMBL1893236- UNII
- D573F0T1Z0
- Nikkaji
- J54.554F
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 435
Physicochemical properties
- FDA UNII
- 573 F0T1Z0 · D573F0T1Z0
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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