thieno[2,3-h]isoquinoline

C11H7NS — CID 15192975

IUPACthieno[2,3-h]isoquinoline
SMILESc1cc2ccc3sccc3c2cn1
InChIInChI=1S/C11H7NS/c1-2-11-9(4-6-13-11)10-7-12-5-3-8(1)10/h1-7H
InChIKeyVTHUHAKIWQTSNK-UHFFFAOYSA-N
MW185.25 g/mol
LogP3.45
Rot. Bonds

About thieno[2,3-h]isoquinoline

thieno[2,3-h]isoquinoline (PubChem CID 15192975) has the molecular formula C11H7NS and a molecular weight of 185.25 g/mol. Its IUPAC name is thieno[2,3-h]isoquinoline.

Molecular Properties

Compound Namethieno[2,3-h]isoquinoline
PubChem CID15192975
Molecular FormulaC11H7NS
Molecular Weight185.25 g/mol
Exact Mass185.03
IUPAC Namethieno[2,3-h]isoquinoline
SMILESc1cc2ccc3sccc3c2cn1
InChIInChI=1S/C11H7NS/c1-2-11-9(4-6-13-11)10-7-12-5-3-8(1)10/h1-7H
InChIKeyVTHUHAKIWQTSNK-UHFFFAOYSA-N
XLogP3.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of thieno[2,3-h]isoquinoline?
The IUPAC name of thieno[2,3-h]isoquinoline (CID 15192975) is thieno[2,3-h]isoquinoline.
What is the SMILES notation for thieno[2,3-h]isoquinoline?
The canonical SMILES for thieno[2,3-h]isoquinoline is c1cc2ccc3sccc3c2cn1.
What is the InChIKey of thieno[2,3-h]isoquinoline?
The InChIKey is VTHUHAKIWQTSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NS/c1-2-11-9(4-6-13-11)10-7-12-5-3-8(1)10/h1-7H.
What are the key properties of thieno[2,3-h]isoquinoline?
thieno[2,3-h]isoquinoline has a molecular weight of 185.25 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[2,3-h]isoquinoline is sourced from PubChem (CID 15192975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).