(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol

C12H10OS3 — CID 115807767

IUPAC(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol
SMILESCc1cc(C(O)c2cc3sccc3s2)cs1
InChIInChI=1S/C12H10OS3/c1-7-4-8(6-15-7)12(13)11-5-10-9(16-11)2-3-14-10/h2-6,12-13H,1H3
InChIKeyDIHYYFLXTKHLAJ-UHFFFAOYSA-N
MW266.41 g/mol
LogP4.41
Rot. Bonds2

About (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol

(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol (PubChem CID 115807767) has the molecular formula C12H10OS3 and a molecular weight of 266.41 g/mol. Its IUPAC name is (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol.

Molecular Properties

Compound Name(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol
PubChem CID115807767
Molecular FormulaC12H10OS3
Molecular Weight266.41 g/mol
Exact Mass265.99
IUPAC Name(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol
SMILESCc1cc(C(O)c2cc3sccc3s2)cs1
InChIInChI=1S/C12H10OS3/c1-7-4-8(6-15-7)12(13)11-5-10-9(16-11)2-3-14-10/h2-6,12-13H,1H3
InChIKeyDIHYYFLXTKHLAJ-UHFFFAOYSA-N
XLogP4.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol
CID 65099731
(4-fluorophenyl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 80745407
(2-methylphenyl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 114979263
[4-(2-methylpropyl)phenyl]-thieno[3,2-b]thiophen-5-ylmethanol
CID 80744923
[4-(2-methylbutan-2-yl)phenyl]-thieno[3,2-b]thiophen-5-ylmethanol
CID 80738896
[4-(2-methoxyethyl)phenyl]-thieno[3,2-b]thiophen-5-ylmethanol
CID 80746017
chloro(thieno[3,2-b]thiophen-5-yl)methanol
CID 123645090
(5-ethoxy-3-pyridinyl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 115829098
(2-chloro-4-fluoro-5-methylphenyl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 81044859
1-thieno[3,2-b]thiophen-5-ylbutan-1-ol
CID 115780945
(5-bromo-4-chlorothiophen-2-yl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 80744829
(7-methyl-1-benzofuran-2-yl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 115836487

Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol?
The IUPAC name of (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol (CID 115807767) is (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol.
What is the SMILES notation for (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol?
The canonical SMILES for (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol is Cc1cc(C(O)c2cc3sccc3s2)cs1.
What is the InChIKey of (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol?
The InChIKey is DIHYYFLXTKHLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10OS3/c1-7-4-8(6-15-7)12(13)11-5-10-9(16-11)2-3-14-10/h2-6,12-13H,1H3.
What are the key properties of (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol?
(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol has a molecular weight of 266.41 g/mol, XLogP of 4.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol is sourced from PubChem (CID 115807767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).