N-{[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl}-2-(pyridin-2-yloxy)acetamide monohydrochloride

HCID 66975109
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Basic information

Standard SMILES
Cl.O=C(COc1ccccn1)NC[C@@H]1CNCCO[C@H]1c1ccc(Cl)c(F)c1
InChIKey
UNDZDOHMPRAWAW-JPJJPTBZSA-N
Molecular formula
C19H22Cl2FN3O3
Average molar mass
430.3 g/mol

Names & identifiers

Preferred name
N-{[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl}-2-(pyridin-2-yloxy)acetamide monohydrochloride
IUPAC
N-[[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl]-2-pyridin-2-yloxyacetamide;hydrochloride

Names & synonyms

SCHEMBL1279788UNDZDOHMPRAWAW-JPJJPTBZSA-NN-{[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl}-2-(pyridin-2-yloxy)acetamide monohydrochloride

Database identifiers

PubChem CID
66975109

Properties

Computed structural properties

Topological polar surface area
72.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
28

Related reactions

1 records
New reaction record

Linked notes

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N-{[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl}-2-(pyridin-2-yloxy)acetamide monohydrochloride (HCID 66975109)｜Huagongshe