Basic information
- CAS
64038-11-5- Standard SMILES
CCC1(c2ccccc2)C(=O)NC(=O)N(CC(COCC(C)C)OC(N)=O)C1=O- InChIKey
SFZKMHDKOKGUPG-UHFFFAOYSA-N- Molecular formula
- C20H27N3O6
- Average molar mass
- 405.4 g/mol
- Monoisotopic mass
- 405.18998559
Names & identifiers
- Preferred name
- 1-(5-Ethyl-4-hydroxy-2,6-dioxo-5-phenyl-5,6-dihydropyrimidin-1(2H)-yl)-3-(2-methylpropoxy)propan-2-yl hydrogen carbonimidate
- IUPAC
- [1-(5-ethyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)-3-(2-methylpropoxy)propan-2-yl] carbamate
- English name
- 1-[2-(Aminocarbonyloxy)-3-isobutyloxypropyl]-5-ethyl-5-phenylbarbituric acid
- Molecular formula
- C20H27N3O6
- Molecular weight
- 0
Names & synonyms
64038-11-5DTXSID009820591-(5-Ethyl-4-hydroxy-2,6-dioxo-5-phenyl-5,6-dihydropyrimidin-1(2H)-yl)-3-(2-methylpropoxy)propan-2-yl hydrogen carbonimidateRefChem:1054507DTXCID001409324GO 547BRN 0591579Barbituric acid, 5-ethyl-1-(2-hydroxy-3-isobutoxypropyl)-5-phenyl-, carbamate (ester)DB-2912051-[2-(Aminocarbonyloxy)-3-isobutyloxypropyl ]-5-ethyl-5-phenylbarbituric acid1-[2-(Aminocarbonyloxy)-3-isobutyloxypropyl]-5-ethyl-5-phenylbarbituric acid1-(2-carbamoyloxy-3-isobutoxy-propyl)-5-ethyl-5-phenyl-pyrimidine-2,4,6-trione
Show more names
1-[2-(Aminocarbonyloxy)-3-isobutyloxypropyl]-5-ethyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 632
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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