6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide

C6H8N2O2S — CID 18183098

IUPAC6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide
SMILESO=S1(=O)CCCn2ccnc21
InChIInChI=1S/C6H8N2O2S/c9-11(10)5-1-3-8-4-2-7-6(8)11/h2,4H,1,3,5H2
InChIKeyAJZQHZJCDGSJTM-UHFFFAOYSA-N
MW172.21 g/mol
LogP0.06
Rot. Bonds

About 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide

6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide (PubChem CID 18183098) has the molecular formula C6H8N2O2S and a molecular weight of 172.21 g/mol. Its IUPAC name is 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide.

Molecular Properties

Compound Name6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide
PubChem CID18183098
Molecular FormulaC6H8N2O2S
Molecular Weight172.21 g/mol
Exact Mass172.03
IUPAC Name6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide
SMILESO=S1(=O)CCCn2ccnc21
InChIInChI=1S/C6H8N2O2S/c9-11(10)5-1-3-8-4-2-7-6(8)11/h2,4H,1,3,5H2
InChIKeyAJZQHZJCDGSJTM-UHFFFAOYSA-N
XLogP0.06
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.21
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide?
The IUPAC name of 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide (CID 18183098) is 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide.
What is the SMILES notation for 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide?
The canonical SMILES for 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide is O=S1(=O)CCCn2ccnc21.
What is the InChIKey of 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide?
The InChIKey is AJZQHZJCDGSJTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2S/c9-11(10)5-1-3-8-4-2-7-6(8)11/h2,4H,1,3,5H2.
What are the key properties of 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide?
6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide has a molecular weight of 172.21 g/mol, XLogP of 0.06, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazine 8,8-dioxide is sourced from PubChem (CID 18183098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).