6-phenylthieno[2,3-d]thiadiazole

C10H6N2S2 — CID 70378438

IUPAC6-phenylthieno[2,3-d]thiadiazole
SMILESc1ccc(-c2csc3nnsc23)cc1
InChIInChI=1S/C10H6N2S2/c1-2-4-7(5-3-1)8-6-13-10-9(8)14-12-11-10/h1-6H
InChIKeyYBEVGCAYBKXHHA-UHFFFAOYSA-N
MW218.31 g/mol
LogP3.42
Rot. Bonds1

About 6-phenylthieno[2,3-d]thiadiazole

6-phenylthieno[2,3-d]thiadiazole (PubChem CID 70378438) has the molecular formula C10H6N2S2 and a molecular weight of 218.31 g/mol. Its IUPAC name is 6-phenylthieno[2,3-d]thiadiazole.

Molecular Properties

Compound Name6-phenylthieno[2,3-d]thiadiazole
PubChem CID70378438
Molecular FormulaC10H6N2S2
Molecular Weight218.31 g/mol
Exact Mass218.00
IUPAC Name6-phenylthieno[2,3-d]thiadiazole
SMILESc1ccc(-c2csc3nnsc23)cc1
InChIInChI=1S/C10H6N2S2/c1-2-4-7(5-3-1)8-6-13-10-9(8)14-12-11-10/h1-6H
InChIKeyYBEVGCAYBKXHHA-UHFFFAOYSA-N
XLogP3.42
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.31
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-phenylthieno[2,3-d]thiadiazole?
The IUPAC name of 6-phenylthieno[2,3-d]thiadiazole (CID 70378438) is 6-phenylthieno[2,3-d]thiadiazole.
What is the SMILES notation for 6-phenylthieno[2,3-d]thiadiazole?
The canonical SMILES for 6-phenylthieno[2,3-d]thiadiazole is c1ccc(-c2csc3nnsc23)cc1.
What is the InChIKey of 6-phenylthieno[2,3-d]thiadiazole?
The InChIKey is YBEVGCAYBKXHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N2S2/c1-2-4-7(5-3-1)8-6-13-10-9(8)14-12-11-10/h1-6H.
What are the key properties of 6-phenylthieno[2,3-d]thiadiazole?
6-phenylthieno[2,3-d]thiadiazole has a molecular weight of 218.31 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenylthieno[2,3-d]thiadiazole is sourced from PubChem (CID 70378438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).