N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide

C14H21N3O3S2 — CID 119270867

IUPACN-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C2CSCN2)c1
InChIInChI=1S/C14H21N3O3S2/c1-14(2,3)17-22(19,20)11-6-4-5-10(7-11)16-13(18)12-8-21-9-15-12/h4-7,12,15,17H,8-9H2,1-3H3,(H,16,18)
InChIKeyMVAQVGWMRLPHNP-UHFFFAOYSA-N
MW343.47 g/mol
LogP1.36
Rot. Bonds4

About N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide

N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 119270867) has the molecular formula C14H21N3O3S2 and a molecular weight of 343.47 g/mol. Its IUPAC name is N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
PubChem CID119270867
Molecular FormulaC14H21N3O3S2
Molecular Weight343.47 g/mol
Exact Mass343.10
IUPAC NameN-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C2CSCN2)c1
InChIInChI=1S/C14H21N3O3S2/c1-14(2,3)17-22(19,20)11-6-4-5-10(7-11)16-13(18)12-8-21-9-15-12/h4-7,12,15,17H,8-9H2,1-3H3,(H,16,18)
InChIKeyMVAQVGWMRLPHNP-UHFFFAOYSA-N
XLogP1.36
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide 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-methylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 54862152
N-[3-(tert-butylsulfamoyl)-4-methylphenyl]-1,3-thiazolidine-4-carboxamide
CID 119332384
N-[3-(tert-butylsulfamoyl)phenyl]morpholine-3-carboxamide
CID 119688772
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide
CID 119329159
N-[3-(propanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61250253
N-[3-(propylsulfonylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 119329973
N-[3-(tert-butylsulfamoyl)phenyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119270871
N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119830904
N-(3-ethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24703459
N-[3-(methylcarbamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61258442
N-[3-(2-methylpropanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119281758

Frequently Asked Questions

What is the IUPAC name of N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide (CID 119270867) is N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide is CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C2CSCN2)c1.
What is the InChIKey of N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is MVAQVGWMRLPHNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S2/c1-14(2,3)17-22(19,20)11-6-4-5-10(7-11)16-13(18)12-8-21-9-15-12/h4-7,12,15,17H,8-9H2,1-3H3,(H,16,18).
What are the key properties of N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide?
N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 1.36, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 119270867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).