2-chloro-1,3-thiazole-5-sulfonamide

C3H3ClN2O2S2 — CID 22019518

IUPAC2-chloro-1,3-thiazole-5-sulfonamide
SMILESNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C3H3ClN2O2S2/c4-3-6-1-2(9-3)10(5,7)8/h1H,(H2,5,7,8)
InChIKeyUHNIBSBQJZVNAI-UHFFFAOYSA-N
MW198.66 g/mol
LogP0.44
Rot. Bonds1

About 2-chloro-1,3-thiazole-5-sulfonamide

2-chloro-1,3-thiazole-5-sulfonamide (PubChem CID 22019518) has the molecular formula C3H3ClN2O2S2 and a molecular weight of 198.66 g/mol. Its IUPAC name is 2-chloro-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-1,3-thiazole-5-sulfonamide
PubChem CID22019518
Molecular FormulaC3H3ClN2O2S2
Molecular Weight198.66 g/mol
Exact Mass197.93
IUPAC Name2-chloro-1,3-thiazole-5-sulfonamide
SMILESNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C3H3ClN2O2S2/c4-3-6-1-2(9-3)10(5,7)8/h1H,(H2,5,7,8)
InChIKeyUHNIBSBQJZVNAI-UHFFFAOYSA-N
XLogP0.44
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.66
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-Thiazole-5-sulfonamide
CID 23075930
1,3-Thiazole-5-sulfonyl chloride
CID 53767412
2-Methylthiazole-5-sulfonamide
CID 13517396
2-Chloro-1,3-thiazole-5-sulfonyl chloride
CID 16228943
2-Methyl-1,3-thiazole-5-sulfonyl chloride
CID 53441758
2-Chloro-1,3-thiazole-5-sulfonyl fluoride
CID 165453591
1,3-Thiazole-5-sulfonic acid
CID 13899663
Thiazole-5-sulfonyl fluoride
CID 87552466
2-(Trifluoromethyl)-1,3-thiazole-5-sulfonamide
CID 106784107
2-(Difluoromethyl)-1,3-thiazole-5-sulfonamide
CID 146571332
2-Fluoro-1,3-thiazole-5-sulfonyl chloride
CID 170949440
2-chloro-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 43455886

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-1,3-thiazole-5-sulfonamide (CID 22019518) is 2-chloro-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-1,3-thiazole-5-sulfonamide is NS(=O)(=O)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-1,3-thiazole-5-sulfonamide?
The InChIKey is UHNIBSBQJZVNAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3ClN2O2S2/c4-3-6-1-2(9-3)10(5,7)8/h1H,(H2,5,7,8).
What are the key properties of 2-chloro-1,3-thiazole-5-sulfonamide?
2-chloro-1,3-thiazole-5-sulfonamide has a molecular weight of 198.66 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 22019518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).