Basic information
- CAS
1053-49-2- Standard SMILES
O=C1C(C2CCCCC2)C(=O)N(C2CCCCC2)C(=O)N1c1ccccc1- InChIKey
MSVVAFKSLYXQNS-UHFFFAOYSA-N- Molecular formula
- C22H28N2O3
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.20999276
Names & identifiers
- Preferred name
- 1,5-Dicyclohexyl-3-phenyl-1,3-diazinane-2,4,6-trione
- IUPAC
- 1,5-dicyclohexyl-3-phenyl-1,3-diazinane-2,4,6-trione
- English name
- 1,5-Dicyclohexyl-3-phenylbarbituric acid
- Molecular weight
- 0
Names & synonyms
1053-49-21,5-dicyclohexyl-3-phenyl-1,3-diazinane-2,4,6-trioneDTXSID90909412RefChem:1053430DTXCID5013384751,5-Dicyclohexyl-3-phenylbarbituric acidBRN 0767446BARBITURIC ACID, 1,5-DICYCLOHEXYL-3-PHENYL-1,5-Dicyclohexyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
1053-49-2- PubChem CID
- 13982
- DTXSID
DTXSID90909412- Nikkaji
- J54.562G
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 572
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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