(4-Hydroxy-2,6-dioxo-5-phenyl-5-propyl-5,6-dihydropyrimidin-1(2H)-yl)acetic acid
Basic information
- CAS
33837-13-7- Standard SMILES
CCCC1(c2ccccc2)C(=O)NC(=O)N(CC(=O)O)C1=O- InChIKey
OSQNQGAMWRDQHJ-UHFFFAOYSA-N- Molecular formula
- C15H16N2O5
- Average molar mass
- 304.3 g/mol
- Monoisotopic mass
- 304.10592162
Names & identifiers
- Preferred name
- (4-Hydroxy-2,6-dioxo-5-phenyl-5-propyl-5,6-dihydropyrimidin-1(2H)-yl)acetic acid
- IUPAC
- 2-(2,4,6-trioxo-5-phenyl-5-propyl-1,3-diazinan-1-yl)acetic acid
Names & synonyms
33837-13-7DTXSID60955421(4-Hydroxy-2,6-dioxo-5-phenyl-5-propyl-5,6-dihydropyrimidin-1(2H)-yl)acetic acidRefChem:1050427DTXCID401383415BRN 06993575-Phenyl-5-(2-acetoxypropyl)barbituric acid5-(2-Hydroxypropyl)-5-phenylbarbituric acid 5-acetateBarbituric acid, 5-(2-hydroxypropyl)-5-phenyl-, 5-acetate
Database identifiers
- CAS
33837-13-7- PubChem CID
- 214698
- DTXSID
DTXSID60955421
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 498
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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