1H-indene;thieno[3,2-b]thiophene

C15H12S2 — CID 157394053

IUPAC1H-indene;thieno[3,2-b]thiophene
SMILESC1=Cc2ccccc2C1.c1cc2sccc2s1
InChIInChI=1S/C9H8.C6H4S2/c1-2-5-9-7-3-6-8(9)4-1;1-3-7-6-2-4-8-5(1)6/h1-6H,7H2;1-4H
InChIKeyBMIYMOIGGBSWFC-UHFFFAOYSA-N
MW256.39 g/mol
LogP5.22
Rot. Bonds

About 1H-indene;thieno[3,2-b]thiophene

1H-indene;thieno[3,2-b]thiophene (PubChem CID 157394053) has the molecular formula C15H12S2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1H-indene;thieno[3,2-b]thiophene.

Molecular Properties

Compound Name1H-indene;thieno[3,2-b]thiophene
PubChem CID157394053
Molecular FormulaC15H12S2
Molecular Weight256.39 g/mol
Exact Mass256.04
IUPAC Name1H-indene;thieno[3,2-b]thiophene
SMILESC1=Cc2ccccc2C1.c1cc2sccc2s1
InChIInChI=1S/C9H8.C6H4S2/c1-2-5-9-7-3-6-8(9)4-1;1-3-7-6-2-4-8-5(1)6/h1-6H,7H2;1-4H
InChIKeyBMIYMOIGGBSWFC-UHFFFAOYSA-N
XLogP5.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.39
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1H-indene;thieno[3,2-b]thiophene?
The IUPAC name of 1H-indene;thieno[3,2-b]thiophene (CID 157394053) is 1H-indene;thieno[3,2-b]thiophene.
What is the SMILES notation for 1H-indene;thieno[3,2-b]thiophene?
The canonical SMILES for 1H-indene;thieno[3,2-b]thiophene is C1=Cc2ccccc2C1.c1cc2sccc2s1.
What is the InChIKey of 1H-indene;thieno[3,2-b]thiophene?
The InChIKey is BMIYMOIGGBSWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8.C6H4S2/c1-2-5-9-7-3-6-8(9)4-1;1-3-7-6-2-4-8-5(1)6/h1-6H,7H2;1-4H.
What are the key properties of 1H-indene;thieno[3,2-b]thiophene?
1H-indene;thieno[3,2-b]thiophene has a molecular weight of 256.39 g/mol, XLogP of 5.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indene;thieno[3,2-b]thiophene is sourced from PubChem (CID 157394053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).