BN 50739

Ligand id: 1851

Name: BN 50739

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 150.4
Molecular weight 595.09
XLogP 6.04
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
9-(2-chlorophenyl)-14-{2-[(3,4-dimethoxyphenyl)sulfanyl]ethanethioyl}-3-methyl-17-thia-2,4,5,8,14-pentaazatetracyclo[8.7.0.0^{2,6}.0^{11,16}]heptadeca-1(10),3,5,8,11(16)-pentaene
Synonyms
BN-50739 | BN50739
Database Links
PubChem CID 115002
Search Google for chemical match using the InChIKey MRVWRDZEYURFSW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MRVWRDZEYURFSW
Search UniChem for chemical match using the InChIKey MRVWRDZEYURFSW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MRVWRDZEYURFSW