8-Chloro-4,6-dimethyl-2-(tetrahydrofuran-2-yl)-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepine

HCID 57512899
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Basic information

Standard SMILES
Cc1cc(Cl)nc2c1CN(C)CC(C1CCCO1)O2
InChIKey
VYBPRVDAZGLUBE-UHFFFAOYSA-N
Molecular formula
C14H19ClN2O2
Average molar mass
282.76 g/mol

Names & identifiers

Preferred name
8-Chloro-4,6-dimethyl-2-(tetrahydrofuran-2-yl)-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepine
IUPAC
8-chloro-4,6-dimethyl-2-(oxolan-2-yl)-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepine

Names & synonyms

SCHEMBL3699348VYBPRVDAZGLUBE-UHFFFAOYSA-N8-chloro-4,6-dimethyl-2-(tetrahydrofuran-2-yl)-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepine

Database identifiers

PubChem CID
57512899

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
34.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
19

Related reactions

1 records
New reaction record

Linked notes

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