2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid

C10H14N2O4S2 — CID 90044718

IUPAC2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid
SMILESO=C(O)c1csc(S(=O)(=O)NC2CCCCC2)n1
InChIInChI=1S/C10H14N2O4S2/c13-9(14)8-6-17-10(11-8)18(15,16)12-7-4-2-1-3-5-7/h6-7,12H,1-5H2,(H,13,14)
InChIKeyVSZUSIPLBKNGNS-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.45
Rot. Bonds4

About 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid

2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid (PubChem CID 90044718) has the molecular formula C10H14N2O4S2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid.

Molecular Properties

Compound Name2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid
PubChem CID90044718
Molecular FormulaC10H14N2O4S2
Molecular Weight290.37 g/mol
Exact Mass290.04
IUPAC Name2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid
SMILESO=C(O)c1csc(S(=O)(=O)NC2CCCCC2)n1
InChIInChI=1S/C10H14N2O4S2/c13-9(14)8-6-17-10(11-8)18(15,16)12-7-4-2-1-3-5-7/h6-7,12H,1-5H2,(H,13,14)
InChIKeyVSZUSIPLBKNGNS-UHFFFAOYSA-N
XLogP1.45
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(cycloheptylsulfamoyl)thiophene-3-carboxylic acid
CID 43091190
2-(cyclohexylcarbamoylamino)-1,3-thiazole-4-carboxylic acid
CID 28858154
2-[2-(cyclopentylamino)-2-oxoethyl]-1,3-thiazole-4-carboxylic acid
CID 82154985
2-[(cyclopropylsulfamoylamino)methyl]-1,3-thiazole-4-carboxylic acid
CID 114533520
5-(cyclooctylsulfamoyl)thiophene-2-carboxylic acid
CID 61026859
2-[1-(cycloheptylcarbamoylamino)ethyl]-1,3-thiazole-4-carboxylic acid
CID 66373521
2-[(cyclopentylsulfonylamino)methyl]-1,3-thiazole-4-carboxylic acid
CID 105360892
4-(cycloheptylsulfamoyl)thiophene-2-carboxamide
CID 6486058
2-[(cycloheptanecarbonylamino)methyl]-1,3-thiazole-4-carboxylic acid
CID 66380665
6-(cyclooctylamino)pyridazine-3-carboxylic acid
CID 60792420
2-[(cyclobutylcarbamoylamino)methyl]-1,3-thiazole-4-carboxylic acid
CID 66381336
azepan-1-yl-[2-(cyclopropylamino)-1,3-thiazol-4-yl]methanone
CID 71702866

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid?
The IUPAC name of 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid (CID 90044718) is 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid.
What is the SMILES notation for 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid?
The canonical SMILES for 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid is O=C(O)c1csc(S(=O)(=O)NC2CCCCC2)n1.
What is the InChIKey of 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid?
The InChIKey is VSZUSIPLBKNGNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S2/c13-9(14)8-6-17-10(11-8)18(15,16)12-7-4-2-1-3-5-7/h6-7,12H,1-5H2,(H,13,14).
What are the key properties of 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid?
2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid has a molecular weight of 290.37 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylsulfamoyl)-1,3-thiazole-4-carboxylic acid is sourced from PubChem (CID 90044718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).