Basic information
- CAS
4192-33-0- Standard SMILES
CCCCCCC1C(=O)NC(=O)N(C2CCCCC2)C1=O- InChIKey
MSNOVYXXOZYRDG-UHFFFAOYSA-N- Molecular formula
- C16H26N2O3
- Average molar mass
- 294.39 g/mol
- Monoisotopic mass
- 294.1943427
Names & identifiers
- Preferred name
- 1-Cyclohexyl-5-hexyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- IUPAC
- 1-cyclohexyl-5-hexyl-1,3-diazinane-2,4,6-trione
- English name
- 1-Cyclohexyl-5-hexylbarbituric acid
- Molecular formula
- C16H26N2O3
- Molecular weight
- 294.39
Names & synonyms
4192-33-01-Cyclohexyl-5-hexyl-2,4,6(1H,3H,5H)-pyrimidinetrioneRefChem:10553081-Cyclohexyl-5-hexylbarbituric acidBRN 0757673BARBITURIC ACID, 1-CYCLOHEXYL-5-HEXYL-2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-cyclohexyl-5-hexyl-5-24-09-00160 (Beilstein Handbook Reference)SCHEMBL1426501DTXSID409620523-Cyclohexyl-5-hexyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Database identifiers
- CAS
4192-33-0- PubChem CID
- 20162
- DTXSID
DTXSID40962052- Nikkaji
- J54.735B
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 402
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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