2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole

C18H10N4OS2 — CID 126749717

IUPAC2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole
SMILESc1ccc2c(c1)nc1sc(Oc3cn4c(nc5ccccc54)s3)cn12
InChIInChI=1S/C18H10N4OS2/c1-3-7-13-11(5-1)19-17-21(13)9-15(24-17)23-16-10-22-14-8-4-2-6-12(14)20-18(22)25-16/h1-10H
InChIKeyWDMFIWNNCWXQFC-UHFFFAOYSA-N
MW362.44 g/mol
LogP5.20
Rot. Bonds2

About 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole

2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole (PubChem CID 126749717) has the molecular formula C18H10N4OS2 and a molecular weight of 362.44 g/mol. Its IUPAC name is 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole.

Molecular Properties

Compound Name2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole
PubChem CID126749717
Molecular FormulaC18H10N4OS2
Molecular Weight362.44 g/mol
Exact Mass362.03
IUPAC Name2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole
SMILESc1ccc2c(c1)nc1sc(Oc3cn4c(nc5ccccc54)s3)cn12
InChIInChI=1S/C18H10N4OS2/c1-3-7-13-11(5-1)19-17-21(13)9-15(24-17)23-16-10-22-14-8-4-2-6-12(14)20-18(22)25-16/h1-10H
InChIKeyWDMFIWNNCWXQFC-UHFFFAOYSA-N
XLogP5.20
TPSA43.83 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.44
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole?
The IUPAC name of 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole (CID 126749717) is 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole.
What is the SMILES notation for 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole?
The canonical SMILES for 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole is c1ccc2c(c1)nc1sc(Oc3cn4c(nc5ccccc54)s3)cn12.
What is the InChIKey of 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole?
The InChIKey is WDMFIWNNCWXQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10N4OS2/c1-3-7-13-11(5-1)19-17-21(13)9-15(24-17)23-16-10-22-14-8-4-2-6-12(14)20-18(22)25-16/h1-10H.
What are the key properties of 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole?
2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole has a molecular weight of 362.44 g/mol, XLogP of 5.20, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,3]thiazolo[3,2-a]benzimidazol-2-yloxy)-[1,3]thiazolo[3,2-a]benzimidazole is sourced from PubChem (CID 126749717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).