Basic information
- Standard SMILES
CCCCCCCCCCCC(=O)OCCN1CCN=C(C)CC1=O- InChIKey
DQIJEUUQCBTDIO-UHFFFAOYSA-N- Molecular formula
- C20H36N2O3
- Average molar mass
- 352.5 g/mol
Names & identifiers
- Preferred name
- 4-lauroyloxyethyl-7-methyl-3,6-dihydro-2H-1,4-diazepin-5-one
- IUPAC
- 2-(5-methyl-7-oxo-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl dodecanoate
Names & synonyms
SCHEMBL11251328DQIJEUUQCBTDIO-UHFFFAOYSA-N4-lauroyloxyethyl-7-methyl-3,6-dihydro-2H-1,4-diazepin-5-one
Database identifiers
- PubChem CID
- 53773609
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 421
Related reactions
1 records
Compound notes
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