1,3-Dicyclohexyl-5-(2-hydroxypropyl)-5-(prop-2-en-1-yl)-1,3-diazinan-2-one
Basic information
- CAS
35957-57-4- Standard SMILES
C=CCC1(CC(C)O)CN(C2CCCCC2)C(=O)N(C2CCCCC2)C1- InChIKey
PMDIHOLLEQNGKZ-UHFFFAOYSA-N- Molecular formula
- C22H38N2O2
- Average molar mass
- 362.5 g/mol
- Monoisotopic mass
- 362.29332846
Names & identifiers
- Preferred name
- 1,3-Dicyclohexyl-5-(2-hydroxypropyl)-5-(prop-2-en-1-yl)-1,3-diazinan-2-one
- IUPAC
- 1,3-dicyclohexyl-5-(2-hydroxypropyl)-5-prop-2-enyl-1,3-diazinan-2-one
Names & synonyms
35957-57-4DTXSID409573621,3-Dicyclohexyl-5-(2-hydroxypropyl)-5-(prop-2-en-1-yl)-1,3-diazinan-2-oneRefChem:1052819DTXCID701385303Tetrahydro-1,3-dicyclohexyl-5-(2-hydroxypropyl)-5-(2-propenyl)-2(1H)-pyrimidinone2(1H)-Pyrimidinone, tetrahydro-1,3-dicyclohexyl-5-(2-hydroxypropyl)-5-(2-propenyl)-
Database identifiers
- CAS
35957-57-4- PubChem CID
- 215619
- DTXSID
DTXSID40957362
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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