8-methylthieno[2,3-e][1,2]benzothiazole

C10H7NS2 — CID 6484328

IUPAC8-methylthieno[2,3-e][1,2]benzothiazole
SMILESCc1nsc2ccc3ccsc3c12
InChIInChI=1S/C10H7NS2/c1-6-9-8(13-11-6)3-2-7-4-5-12-10(7)9/h2-5H,1H3
InChIKeyWFGMELZQIVHKIT-UHFFFAOYSA-N
MW205.31 g/mol
LogP3.82
Rot. Bonds

About 8-methylthieno[2,3-e][1,2]benzothiazole

8-methylthieno[2,3-e][1,2]benzothiazole (PubChem CID 6484328) has the molecular formula C10H7NS2 and a molecular weight of 205.31 g/mol. Its IUPAC name is 8-methylthieno[2,3-e][1,2]benzothiazole.

Molecular Properties

Compound Name8-methylthieno[2,3-e][1,2]benzothiazole
PubChem CID6484328
Molecular FormulaC10H7NS2
Molecular Weight205.31 g/mol
Exact Mass205.00
IUPAC Name8-methylthieno[2,3-e][1,2]benzothiazole
SMILESCc1nsc2ccc3ccsc3c12
InChIInChI=1S/C10H7NS2/c1-6-9-8(13-11-6)3-2-7-4-5-12-10(7)9/h2-5H,1H3
InChIKeyWFGMELZQIVHKIT-UHFFFAOYSA-N
XLogP3.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methylthieno[2,3-e][1,2]benzothiazole?
The IUPAC name of 8-methylthieno[2,3-e][1,2]benzothiazole (CID 6484328) is 8-methylthieno[2,3-e][1,2]benzothiazole.
What is the SMILES notation for 8-methylthieno[2,3-e][1,2]benzothiazole?
The canonical SMILES for 8-methylthieno[2,3-e][1,2]benzothiazole is Cc1nsc2ccc3ccsc3c12.
What is the InChIKey of 8-methylthieno[2,3-e][1,2]benzothiazole?
The InChIKey is WFGMELZQIVHKIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NS2/c1-6-9-8(13-11-6)3-2-7-4-5-12-10(7)9/h2-5H,1H3.
What are the key properties of 8-methylthieno[2,3-e][1,2]benzothiazole?
8-methylthieno[2,3-e][1,2]benzothiazole has a molecular weight of 205.31 g/mol, XLogP of 3.82, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylthieno[2,3-e][1,2]benzothiazole is sourced from PubChem (CID 6484328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).