5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole

C6H8N4O2S2 — CID 19605158

IUPAC5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole
SMILESNS(=O)(=O)NCc1ncc2sccn12
InChIInChI=1S/C6H8N4O2S2/c7-14(11,12)9-3-5-8-4-6-10(5)1-2-13-6/h1-2,4,9H,3H2,(H2,7,11,12)
InChIKeyJPEWVJAUTHNZNR-UHFFFAOYSA-N
MW232.29 g/mol
LogP-0.31
Rot. Bonds3

About 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole

5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole (PubChem CID 19605158) has the molecular formula C6H8N4O2S2 and a molecular weight of 232.29 g/mol. Its IUPAC name is 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole.

Molecular Properties

Compound Name5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole
PubChem CID19605158
Molecular FormulaC6H8N4O2S2
Molecular Weight232.29 g/mol
Exact Mass232.01
IUPAC Name5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole
SMILESNS(=O)(=O)NCc1ncc2sccn12
InChIInChI=1S/C6H8N4O2S2/c7-14(11,12)9-3-5-8-4-6-10(5)1-2-13-6/h1-2,4,9H,3H2,(H2,7,11,12)
InChIKeyJPEWVJAUTHNZNR-UHFFFAOYSA-N
XLogP-0.31
TPSA89.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole?
The IUPAC name of 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole (CID 19605158) is 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole.
What is the SMILES notation for 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole?
The canonical SMILES for 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole is NS(=O)(=O)NCc1ncc2sccn12.
What is the InChIKey of 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole?
The InChIKey is JPEWVJAUTHNZNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O2S2/c7-14(11,12)9-3-5-8-4-6-10(5)1-2-13-6/h1-2,4,9H,3H2,(H2,7,11,12).
What are the key properties of 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole?
5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole has a molecular weight of 232.29 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(sulfamoylamino)methyl]imidazo[5,1-b][1,3]thiazole is sourced from PubChem (CID 19605158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).