6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

C14H13ClN4O3S2 — CID 2353740

IUPAC6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2c(Cl)nc3sccn23)cc1
InChIInChI=1S/C14H13ClN4O3S2/c15-12-11(19-7-8-23-14(19)18-12)13(20)17-6-5-9-1-3-10(4-2-9)24(16,21)22/h1-4,7-8H,5-6H2,(H,17,20)(H2,16,21,22)
InChIKeyZHJTYJFLQNUQQZ-UHFFFAOYSA-N
MW384.87 g/mol
LogP1.67
Rot. Bonds5

About 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 2353740) has the molecular formula C14H13ClN4O3S2 and a molecular weight of 384.87 g/mol. Its IUPAC name is 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID2353740
Molecular FormulaC14H13ClN4O3S2
Molecular Weight384.87 g/mol
Exact Mass384.01
IUPAC Name6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2c(Cl)nc3sccn23)cc1
InChIInChI=1S/C14H13ClN4O3S2/c15-12-11(19-7-8-23-14(19)18-12)13(20)17-6-5-9-1-3-10(4-2-9)24(16,21)22/h1-4,7-8H,5-6H2,(H,17,20)(H2,16,21,22)
InChIKeyZHJTYJFLQNUQQZ-UHFFFAOYSA-N
XLogP1.67
TPSA106.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.87
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-N-(2-phenylethyl)imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 126471386
6-phenyl-N-(2-phenylethyl)imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 142505368
4-methyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-2-carboxamide
CID 110696130
N-[2-(4-sulfamoylphenyl)ethyl]-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270177
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-4-sulfamoylbenzamide
CID 77083416
2-(3,4-dichlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 4784267
N-[2-(4-sulfamoylphenyl)ethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 18272294
2-pyrrol-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 110688566
N-[2-(4-sulfamoylphenyl)ethyl]pyridazine-3-carboxamide
CID 165352801
2-chloro-6-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide
CID 84576032
2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 121038232
N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002532

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 2353740) is 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is NS(=O)(=O)c1ccc(CCNC(=O)c2c(Cl)nc3sccn23)cc1.
What is the InChIKey of 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is ZHJTYJFLQNUQQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN4O3S2/c15-12-11(19-7-8-23-14(19)18-12)13(20)17-6-5-9-1-3-10(4-2-9)24(16,21)22/h1-4,7-8H,5-6H2,(H,17,20)(H2,16,21,22).
What are the key properties of 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 384.87 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 2353740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).