N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide

C7H6ClN3O3S2 — CID 22998496

IUPACN-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide
SMILESCc1noc(NS(=O)(=O)c2nccs2)c1Cl
InChIInChI=1S/C7H6ClN3O3S2/c1-4-5(8)6(14-10-4)11-16(12,13)7-9-2-3-15-7/h2-3,11H,1H3
InChIKeyBGEOYNNWNRFHSR-UHFFFAOYSA-N
MW279.73 g/mol
LogP1.89
Rot. Bonds3

About N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide

N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide (PubChem CID 22998496) has the molecular formula C7H6ClN3O3S2 and a molecular weight of 279.73 g/mol. Its IUPAC name is N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide.

Molecular Properties

Compound NameN-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide
PubChem CID22998496
Molecular FormulaC7H6ClN3O3S2
Molecular Weight279.73 g/mol
Exact Mass278.95
IUPAC NameN-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide
SMILESCc1noc(NS(=O)(=O)c2nccs2)c1Cl
InChIInChI=1S/C7H6ClN3O3S2/c1-4-5(8)6(14-10-4)11-16(12,13)7-9-2-3-15-7/h2-3,11H,1H3
InChIKeyBGEOYNNWNRFHSR-UHFFFAOYSA-N
XLogP1.89
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-dimethyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide
CID 22998450
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-2-formylthiophene-3-sulfonamide
CID 86691256
methyl 2-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-3-carboxylate
CID 174365754
3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]-N-(2,4,6-trimethylphenyl)thiophene-2-carboxamide
CID 70060324
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)propan-2-yl]-1,3-thiazole-2-sulfonamide
CID 126800198
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-2-[2-(4,5-dihydroxy-2-methylphenyl)acetyl]thiophene-3-sulfonamide
CID 71055563
2-acetyl-N-(4-chloro-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide;2-(2,6-dimethylphenyl)acetic acid
CID 174436592
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-2-(naphthalen-1-ylmethyl)thieno[2,3-b]pyridine-3-sulfonamide
CID 12044911
3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]-N-ethyl-N-(4-methoxyphenyl)thiophene-2-carboxamide
CID 70248458
3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]-N-(6-methyl-1,3-benzodioxol-5-yl)thiophene-2-carboxamide
CID 10226215
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-2-[2-[3-(hydroxymethyl)-2,4,6-trimethylphenyl]acetyl]thiophene-3-sulfonamide
CID 23445289
[3-(dimethylamino)phenyl] 3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carboxylate
CID 23445293

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide?
The IUPAC name of N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide (CID 22998496) is N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide.
What is the SMILES notation for N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide?
The canonical SMILES for N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide is Cc1noc(NS(=O)(=O)c2nccs2)c1Cl.
What is the InChIKey of N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide?
The InChIKey is BGEOYNNWNRFHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN3O3S2/c1-4-5(8)6(14-10-4)11-16(12,13)7-9-2-3-15-7/h2-3,11H,1H3.
What are the key properties of N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide?
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide has a molecular weight of 279.73 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-1,3-thiazole-2-sulfonamide is sourced from PubChem (CID 22998496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).