thiadiazol-5-yl(thiophen-2-yl)methanol

C7H6N2OS2 — CID 105079974

IUPACthiadiazol-5-yl(thiophen-2-yl)methanol
SMILESOC(c1cccs1)c1cnns1
InChIInChI=1S/C7H6N2OS2/c10-7(5-2-1-3-11-5)6-4-8-9-12-6/h1-4,7,10H
InChIKeyGWWYMNUPVJBBJS-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.68
Rot. Bonds2

About thiadiazol-5-yl(thiophen-2-yl)methanol

thiadiazol-5-yl(thiophen-2-yl)methanol (PubChem CID 105079974) has the molecular formula C7H6N2OS2 and a molecular weight of 198.27 g/mol. Its IUPAC name is thiadiazol-5-yl(thiophen-2-yl)methanol.

Molecular Properties

Compound Namethiadiazol-5-yl(thiophen-2-yl)methanol
PubChem CID105079974
Molecular FormulaC7H6N2OS2
Molecular Weight198.27 g/mol
Exact Mass197.99
IUPAC Namethiadiazol-5-yl(thiophen-2-yl)methanol
SMILESOC(c1cccs1)c1cnns1
InChIInChI=1S/C7H6N2OS2/c10-7(5-2-1-3-11-5)6-4-8-9-12-6/h1-4,7,10H
InChIKeyGWWYMNUPVJBBJS-UHFFFAOYSA-N
XLogP1.68
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-Methylthiophen-3-yl)-(thiadiazol-5-yl)methanol
CID 102842463
(4-Methylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079900
(4-Ethylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079958
(4-Propylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079979
1-(4-Methylthiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087134
1-(4-Ethylthiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087163
1-(Thiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087175
1-(4-Propylthiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087181
2-(5-Bromothiophen-2-yl)-1-(thiadiazol-5-yl)ethanol
CID 105087311
2-(5-Chlorothiophen-2-yl)-1-(thiadiazol-5-yl)ethanol
CID 105087440
2-(5-Ethylthiophen-2-yl)-1-(thiadiazol-5-yl)ethanol
CID 105087705
1-(Thiadiazol-5-yl)-2-thiophen-3-ylethanol
CID 105089517

Frequently Asked Questions

What is the IUPAC name of thiadiazol-5-yl(thiophen-2-yl)methanol?
The IUPAC name of thiadiazol-5-yl(thiophen-2-yl)methanol (CID 105079974) is thiadiazol-5-yl(thiophen-2-yl)methanol.
What is the SMILES notation for thiadiazol-5-yl(thiophen-2-yl)methanol?
The canonical SMILES for thiadiazol-5-yl(thiophen-2-yl)methanol is OC(c1cccs1)c1cnns1.
What is the InChIKey of thiadiazol-5-yl(thiophen-2-yl)methanol?
The InChIKey is GWWYMNUPVJBBJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2OS2/c10-7(5-2-1-3-11-5)6-4-8-9-12-6/h1-4,7,10H.
What are the key properties of thiadiazol-5-yl(thiophen-2-yl)methanol?
thiadiazol-5-yl(thiophen-2-yl)methanol has a molecular weight of 198.27 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for thiadiazol-5-yl(thiophen-2-yl)methanol is sourced from PubChem (CID 105079974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).