N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide

C10H12BrN3O3S2 — CID 43711294

IUPACN-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CSCN2)c(Br)c1
InChIInChI=1S/C10H12BrN3O3S2/c11-7-3-6(19(12,16)17)1-2-8(7)14-10(15)9-4-18-5-13-9/h1-3,9,13H,4-5H2,(H,14,15)(H2,12,16,17)
InChIKeyXZUKDNKBZLTIOG-UHFFFAOYSA-N
MW366.26 g/mol
LogP0.70
Rot. Bonds3

About N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide

N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 43711294) has the molecular formula C10H12BrN3O3S2 and a molecular weight of 366.26 g/mol. Its IUPAC name is N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide
PubChem CID43711294
Molecular FormulaC10H12BrN3O3S2
Molecular Weight366.26 g/mol
Exact Mass364.95
IUPAC NameN-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CSCN2)c(Br)c1
InChIInChI=1S/C10H12BrN3O3S2/c11-7-3-6(19(12,16)17)1-2-8(7)14-10(15)9-4-18-5-13-9/h1-3,9,13H,4-5H2,(H,14,15)(H2,12,16,17)
InChIKeyXZUKDNKBZLTIOG-UHFFFAOYSA-N
XLogP0.70
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.26
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromo-4-sulfamoylphenyl)thiomorpholine-3-carboxamide
CID 82908517
N-(2-bromo-4-cyanophenyl)-1,3-thiazolidine-4-carboxamide
CID 43709146
N-(2-bromo-4-sulfamoylphenyl)cyclopropanecarboxamide
CID 43134105
N-(2-hydroxy-5-methylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 81433795
N-(2-fluoro-5-methylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 43708243
N-(4-bromo-2-ethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 81291659
N-(2,4-dibromo-5-methoxyphenyl)-1,3-thiazolidine-4-carboxamide
CID 103413589
N-(5-bromo-2-chlorophenyl)-1,3-thiazolidine-4-carboxamide
CID 62908918
(3R)-N-(2-bromo-4-sulfamoylphenyl)piperidine-3-carboxamide
CID 81125256
(3S)-N-(2-bromo-4-sulfamoylphenyl)piperidine-3-carboxamide
CID 81125110
N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide
CID 82905967
N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119262947

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide (CID 43711294) is N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide is NS(=O)(=O)c1ccc(NC(=O)C2CSCN2)c(Br)c1.
What is the InChIKey of N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is XZUKDNKBZLTIOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN3O3S2/c11-7-3-6(19(12,16)17)1-2-8(7)14-10(15)9-4-18-5-13-9/h1-3,9,13H,4-5H2,(H,14,15)(H2,12,16,17).
What are the key properties of N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide?
N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 366.26 g/mol, XLogP of 0.70, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-sulfamoylphenyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 43711294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).