Basic information
- CAS
64038-14-8- Standard SMILES
CCCOCC(CN1C(=O)NC(=O)C(CC)(c2ccccc2)C1=O)OC(N)=O- InChIKey
LWHWYRYDXGQYHF-UHFFFAOYSA-N- Molecular formula
- C19H25N3O6
- Average molar mass
- 391.4 g/mol
- Monoisotopic mass
- 391.17433553
Names & identifiers
- Preferred name
- 1-(5-Ethyl-4-hydroxy-2,6-dioxo-5-phenyl-5,6-dihydropyrimidin-1(2H)-yl)-3-propoxypropan-2-yl hydrogen carbonimidate
- IUPAC
- [1-(5-ethyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)-3-propoxypropan-2-yl] carbamate
- English name
- 1-[2-(Aminocarbonyloxy)-3-propoxypropyl]-5-ethyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C19H25N3O6
- Molecular weight
- 391.42
Names & synonyms
64038-14-8DTXSID309820621-(5-Ethyl-4-hydroxy-2,6-dioxo-5-phenyl-5,6-dihydropyrimidin-1(2H)-yl)-3-propoxypropan-2-yl hydrogen carbonimidateRefChem:1054509DTXCID101409327GO 532BRN 0589903Barbituric acid, 5-ethyl-1-(2-hydroxy-3-propoxypropyl)-5-phenyl-, carbamate (ester)SCHEMBL30675540DB-2912081-[2-(Aminocarbonyloxy)-3-propoxypropyl ]-5-ethyl-5-phenyl-2,4,6(1h,3h,5h)-pyrimidinetrioneGO-532
Show more names
1-[2-(Aminocarbonyloxy)-3-propoxypropyl]-5-ethyl-5-phenylbarbituric acid1-[2-(Aminocarbonyloxy)-3-propoxypropyl]-5-ethyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione2,4,6(2H)-Pyrimidinetrione, 1-[2-[(aminocarbonyl)oxy]-3-propoxypropyl]-5-ethyltetrahydro-5-phenyl-
Database identifiers
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 604
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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