3-[1-(3,4-Dichlorophenyl)-3-(4-(2-oxopiperidino)piperidino)propyl]-2-ethyl-2,3-dihydroisoindol-1-one hydrochloride

HCID 21839996

Basic information

Standard SMILES
CCN1C(=O)c2ccccc2C1C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1.Cl
InChIKey
RLMHJXXYTOGQEH-UHFFFAOYSA-N
Molecular formula
C29H36Cl3N3O2
Average molar mass
565 g/mol
Monoisotopic mass
563.18731

Names & identifiers

Preferred name
3-[1-(3,4-Dichlorophenyl)-3-(4-(2-oxopiperidino)piperidino)propyl]-2-ethyl-2,3-dihydroisoindol-1-one hydrochloride
IUPAC
3-[1-(3,4-dichlorophenyl)-3-[4-(2-oxopiperidin-1-yl)piperidin-1-yl]propyl]-2-ethyl-3H-isoindol-1-one;hydrochloride

Names & synonyms

SCHEMBL7501493RLMHJXXYTOGQEH-UHFFFAOYSA-N3-[1-(3,4-Dichlorophenyl)-3-(4-(2-oxopiperidino)piperidino)propyl]-2-ethyl-2,3-dihydroisoindol-1-one hydrochloride

Database identifiers

PubChem CID
21839996

Properties

Computed structural properties

Topological polar surface area
43.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
37

Related reactions

3 records

Compound notes

Loading…