Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: N18ZH0M4NP

Structure

InChI Key NYKCGQQJNVPOLU-UHFFFAOYSA-N
Smile CN(C(=O)Cc1ccc(Cl)c(Cl)c1)C1CCC2(CCCO2)CC1N1CCCC1
InChI
InChI=1S/C22H30Cl2N2O2/c1-25(21(27)14-16-5-6-17(23)18(24)13-16)19-7-9-22(8-4-12-28-22)15-20(19)26-10-2-3-11-26/h5-6,13,19-20H,2-4,7-12,14-15H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H30Cl2N2O2
Molecular Weight 425.4
AlogP 4.56
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 32.78
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 28.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Bipolar Disorder 1 D001714 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 87151-85-7
ChEMBL CHEMBL118865
FDA SRS N18ZH0M4NP
Guide to Pharmacology 1653
PubChem 55652
SureChEMBL SCHEMBL4545384