3-[2-[4-(2-Chloro-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl]-2-oxazolidinone

HCID 21456045
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1OCCN1CCN1CCN(C2=Cc3cc(Cl)ccc3Sc3ccccc32)CC1
InChIKey
ZGKPMGJLHKZKOL-UHFFFAOYSA-N
Molecular formula
C23H24ClN3O2S
Average molar mass
442 g/mol
Monoisotopic mass
441.1277759

Names & identifiers

Preferred name
3-[2-[4-(2-Chloro-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl]-2-oxazolidinone
IUPAC
3-[2-[4-(3-chlorobenzo[b][1]benzothiepin-6-yl)piperazin-1-yl]ethyl]-1,3-oxazolidin-2-one

Names & synonyms

SCHEMBL11709056ZGKPMGJLHKZKOL-UHFFFAOYSA-N3-[2-[4-(2-chloro-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl]-2-oxazolidinone

Database identifiers

PubChem CID
21456045

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
61.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
30

Related reactions

4 records
New reaction record

Compound notes

Loading…