2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole

C4H7N3O3S2 — CID 103868086

IUPAC2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole
SMILESNS(=O)(=O)NCc1csc(=O)[nH]1
InChIInChI=1S/C4H7N3O3S2/c5-12(9,10)6-1-3-2-11-4(8)7-3/h2,6H,1H2,(H,7,8)(H2,5,9,10)
InChIKeyUGLBGVZZDNEKEY-UHFFFAOYSA-N
MW209.25 g/mol
LogP-1.27
Rot. Bonds3

About 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole

2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole (PubChem CID 103868086) has the molecular formula C4H7N3O3S2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole.

Molecular Properties

Compound Name2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole
PubChem CID103868086
Molecular FormulaC4H7N3O3S2
Molecular Weight209.25 g/mol
Exact Mass208.99
IUPAC Name2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole
SMILESNS(=O)(=O)NCc1csc(=O)[nH]1
InChIInChI=1S/C4H7N3O3S2/c5-12(9,10)6-1-3-2-11-4(8)7-3/h2,6H,1H2,(H,7,8)(H2,5,9,10)
InChIKeyUGLBGVZZDNEKEY-UHFFFAOYSA-N
XLogP-1.27
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole?
The IUPAC name of 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole (CID 103868086) is 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole.
What is the SMILES notation for 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole?
The canonical SMILES for 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole is NS(=O)(=O)NCc1csc(=O)[nH]1.
What is the InChIKey of 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole?
The InChIKey is UGLBGVZZDNEKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O3S2/c5-12(9,10)6-1-3-2-11-4(8)7-3/h2,6H,1H2,(H,7,8)(H2,5,9,10).
What are the key properties of 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole?
2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole has a molecular weight of 209.25 g/mol, XLogP of -1.27, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-4-[(sulfamoylamino)methyl]-3H-1,3-thiazole is sourced from PubChem (CID 103868086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).