Basic information
- Standard SMILES
CC(C)OCC1CN(C)Cc2ccc(Cl)nc2O1- InChIKey
JTGMQKGWSXTMIN-UHFFFAOYSA-N- Molecular formula
- C13H19ClN2O2
- Average molar mass
- 270.75 g/mol
Names & identifiers
- Preferred name
- 8-Chloro-2-(isopropoxymethyl)-4-methyl-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepine
- IUPAC
- 8-chloro-4-methyl-2-(propan-2-yloxymethyl)-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepine
Names & synonyms
SCHEMBL3752444JTGMQKGWSXTMIN-UHFFFAOYSA-N8-chloro-2-(isopropoxymethyl)-4-methyl-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepine
Database identifiers
- PubChem CID
- 59577801
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 34.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 265
Related reactions
1 records
Compound notes
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