Basic information
- CAS
745-31-3- Standard SMILES
CCC(C)C1C(=O)N(C2CCCCC2)C(=O)N(C2CCCCC2)C1=O- InChIKey
GUIGEQUDNHREDY-UHFFFAOYSA-N- Molecular formula
- C20H32N2O3
- Average molar mass
- 348.5 g/mol
- Monoisotopic mass
- 348.24129289
Names & identifiers
- Preferred name
- 5-(Butan-2-yl)-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione
- IUPAC
- 5-butan-2-yl-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione
- English name
- 5-sec-Butyl-1,3-dicyclohexyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular weight
- 0
Names & synonyms
745-31-3DTXSID509960005-(Butan-2-yl)-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trioneRefChem:1072499DTXCID3014230225-sec-Butyl-1,3-dicyclohexylbarbituric acidBRN 07635795-sec-Butyl-1,3-dicyclohexyl-2,4,6(1H,3H,5H)-pyrimidinetrioneBARBITURIC ACID, 5-sec-BUTYL-1,3-DICYCLOHEXYL-2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-sec-butyl-1,3-dicyclohexyl-
Database identifiers
- CAS
745-31-3- PubChem CID
- 12939
- DTXSID
DTXSID50996000- Nikkaji
- J93.534D
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 481
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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