8H-indeno[1,2-d][1,3]thiazole

C10H7NS — CID 87388293

IUPAC8H-indeno[1,2-d][1,3]thiazole
SMILESC1=CCC2=c3ncsc3=CC2=C1
InChIInChI=1S/C10H7NS/c1-2-4-8-7(3-1)5-9-10(8)11-6-12-9/h1-3,5-6H,4H2
InChIKeyZFVIEJPTZRNFMN-UHFFFAOYSA-N
MW173.24 g/mol
LogP0.97
Rot. Bonds

About 8H-indeno[1,2-d][1,3]thiazole

8H-indeno[1,2-d][1,3]thiazole (PubChem CID 87388293) has the molecular formula C10H7NS and a molecular weight of 173.24 g/mol. Its IUPAC name is 8H-indeno[1,2-d][1,3]thiazole.

Molecular Properties

Compound Name8H-indeno[1,2-d][1,3]thiazole
PubChem CID87388293
Molecular FormulaC10H7NS
Molecular Weight173.24 g/mol
Exact Mass173.03
IUPAC Name8H-indeno[1,2-d][1,3]thiazole
SMILESC1=CCC2=c3ncsc3=CC2=C1
InChIInChI=1S/C10H7NS/c1-2-4-8-7(3-1)5-9-10(8)11-6-12-9/h1-3,5-6H,4H2
InChIKeyZFVIEJPTZRNFMN-UHFFFAOYSA-N
XLogP0.97
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8H-indeno[1,2-d][1,3]thiazole?
The IUPAC name of 8H-indeno[1,2-d][1,3]thiazole (CID 87388293) is 8H-indeno[1,2-d][1,3]thiazole.
What is the SMILES notation for 8H-indeno[1,2-d][1,3]thiazole?
The canonical SMILES for 8H-indeno[1,2-d][1,3]thiazole is C1=CCC2=c3ncsc3=CC2=C1.
What is the InChIKey of 8H-indeno[1,2-d][1,3]thiazole?
The InChIKey is ZFVIEJPTZRNFMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NS/c1-2-4-8-7(3-1)5-9-10(8)11-6-12-9/h1-3,5-6H,4H2.
What are the key properties of 8H-indeno[1,2-d][1,3]thiazole?
8H-indeno[1,2-d][1,3]thiazole has a molecular weight of 173.24 g/mol, XLogP of 0.97, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8H-indeno[1,2-d][1,3]thiazole is sourced from PubChem (CID 87388293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).