5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride

C6H3ClN2O2S3 — CID 2769273

IUPAC5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(-c2csnn2)s1
InChIInChI=1S/C6H3ClN2O2S3/c7-14(10,11)6-2-1-5(13-6)4-3-12-9-8-4/h1-3H
InChIKeyYLMRFUGVQGEIMF-UHFFFAOYSA-N
MW266.76 g/mol
LogP2.19
Rot. Bonds2

About 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride

5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride (PubChem CID 2769273) has the molecular formula C6H3ClN2O2S3 and a molecular weight of 266.76 g/mol. Its IUPAC name is 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride.

Molecular Properties

Compound Name5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride
PubChem CID2769273
Molecular FormulaC6H3ClN2O2S3
Molecular Weight266.76 g/mol
Exact Mass265.90
IUPAC Name5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(-c2csnn2)s1
InChIInChI=1S/C6H3ClN2O2S3/c7-14(10,11)6-2-1-5(13-6)4-3-12-9-8-4/h1-3H
InChIKeyYLMRFUGVQGEIMF-UHFFFAOYSA-N
XLogP2.19
TPSA59.92 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.76
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride?
The IUPAC name of 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride (CID 2769273) is 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride.
What is the SMILES notation for 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride?
The canonical SMILES for 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride is O=S(=O)(Cl)c1ccc(-c2csnn2)s1.
What is the InChIKey of 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride?
The InChIKey is YLMRFUGVQGEIMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClN2O2S3/c7-14(10,11)6-2-1-5(13-6)4-3-12-9-8-4/h1-3H.
What are the key properties of 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride?
5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride has a molecular weight of 266.76 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(thiadiazol-4-yl)thiophene-2-sulfonyl chloride is sourced from PubChem (CID 2769273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).