Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: S82A18Y42P

Structure

InChI Key VAZNEHLGJGSQEL-MHZLTWQESA-N
Smile COC(=O)c1cccc(CCN(C)CCC[C@@](C#N)(c2ccc(OC)c(OC)c2)C(C)C)c1
InChI
InChI=1S/C27H36N2O4/c1-20(2)27(19-28,23-11-12-24(31-4)25(18-23)32-5)14-8-15-29(3)16-13-21-9-7-10-22(17-21)26(30)33-6/h7,9-12,17-18,20H,8,13-16H2,1-6H3/t27-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H36N2O4
Molecular Weight 452.6
AlogP 4.86
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 12.0
Polar Surface Area 71.79
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 33.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Tachycardia, Ventricular 3 D017180 ClinicalTrials
Atrial Fibrillation 2 D001281 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 1593673-23-4
ChEMBL CHEMBL3707312
DrugBank DB12605
FDA SRS S82A18Y42P
PubChem 91824132
ZINC ZINC000142261274