2-aminothieno[3,2-d][1,3]thiazin-4-one

C6H4N2OS2 — CID 10631349

IUPAC2-aminothieno[3,2-d][1,3]thiazin-4-one
SMILESNc1nc2ccsc2c(=O)s1
InChIInChI=1S/C6H4N2OS2/c7-6-8-3-1-2-10-4(3)5(9)11-6/h1-2H,(H2,7,8)
InChIKeyHBBKPKSSOOZDJJ-UHFFFAOYSA-N
MW184.25 g/mol
LogP1.30
Rot. Bonds

About 2-aminothieno[3,2-d][1,3]thiazin-4-one

2-aminothieno[3,2-d][1,3]thiazin-4-one (PubChem CID 10631349) has the molecular formula C6H4N2OS2 and a molecular weight of 184.25 g/mol. Its IUPAC name is 2-aminothieno[3,2-d][1,3]thiazin-4-one.

Molecular Properties

Compound Name2-aminothieno[3,2-d][1,3]thiazin-4-one
PubChem CID10631349
Molecular FormulaC6H4N2OS2
Molecular Weight184.25 g/mol
Exact Mass183.98
IUPAC Name2-aminothieno[3,2-d][1,3]thiazin-4-one
SMILESNc1nc2ccsc2c(=O)s1
InChIInChI=1S/C6H4N2OS2/c7-6-8-3-1-2-10-4(3)5(9)11-6/h1-2H,(H2,7,8)
InChIKeyHBBKPKSSOOZDJJ-UHFFFAOYSA-N
XLogP1.30
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.25
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-aminothieno[3,2-d][1,3]thiazin-4-one?
The IUPAC name of 2-aminothieno[3,2-d][1,3]thiazin-4-one (CID 10631349) is 2-aminothieno[3,2-d][1,3]thiazin-4-one.
What is the SMILES notation for 2-aminothieno[3,2-d][1,3]thiazin-4-one?
The canonical SMILES for 2-aminothieno[3,2-d][1,3]thiazin-4-one is Nc1nc2ccsc2c(=O)s1.
What is the InChIKey of 2-aminothieno[3,2-d][1,3]thiazin-4-one?
The InChIKey is HBBKPKSSOOZDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2OS2/c7-6-8-3-1-2-10-4(3)5(9)11-6/h1-2H,(H2,7,8).
What are the key properties of 2-aminothieno[3,2-d][1,3]thiazin-4-one?
2-aminothieno[3,2-d][1,3]thiazin-4-one has a molecular weight of 184.25 g/mol, XLogP of 1.30, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminothieno[3,2-d][1,3]thiazin-4-one is sourced from PubChem (CID 10631349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).