Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: A10BG04
UNII: MY89F08K5D

Structure

InChI Key CHHXEZSCHQVSRE-UHFFFAOYSA-N
Smile COc1ccc(Oc2cc(N(C)CCOc3ccc(CC4SC(=O)NC4=O)cc3)ncn2)cc1
InChI
InChI=1S/C24H24N4O5S/c1-28(21-14-22(26-15-25-21)33-19-9-7-17(31-2)8-10-19)11-12-32-18-5-3-16(4-6-18)13-20-23(29)27-24(30)34-20/h3-10,14-15,20H,11-13H2,1-2H3,(H,27,29,30)

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H24N4O5S
Molecular Weight 480.55
AlogP 3.69
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 10.0
Polar Surface Area 102.88
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 34.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Diabetes Mellitus, Type 2 1 D003924 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 607723-33-1
ChEBI 136052
ChEMBL CHEMBL3585580
DrugBank DB09198
DrugCentral 5078
FDA SRS MY89F08K5D
PubChem 9826451
SureChEMBL SCHEMBL2742697