N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide

C11H14ClN3O3S2 — CID 43706823

IUPACN-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCS(=O)(=O)Nc1ccc(Cl)c(NC(=O)C2CSCN2)c1
InChIInChI=1S/C11H14ClN3O3S2/c1-20(17,18)15-7-2-3-8(12)9(4-7)14-11(16)10-5-19-6-13-10/h2-4,10,13,15H,5-6H2,1H3,(H,14,16)
InChIKeyKWKITHCFWMKDOS-UHFFFAOYSA-N
MW335.84 g/mol
LogP1.31
Rot. Bonds4

About N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide

N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 43706823) has the molecular formula C11H14ClN3O3S2 and a molecular weight of 335.84 g/mol. Its IUPAC name is N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide
PubChem CID43706823
Molecular FormulaC11H14ClN3O3S2
Molecular Weight335.84 g/mol
Exact Mass335.02
IUPAC NameN-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCS(=O)(=O)Nc1ccc(Cl)c(NC(=O)C2CSCN2)c1
InChIInChI=1S/C11H14ClN3O3S2/c1-20(17,18)15-7-2-3-8(12)9(4-7)14-11(16)10-5-19-6-13-10/h2-4,10,13,15H,5-6H2,1H3,(H,14,16)
InChIKeyKWKITHCFWMKDOS-UHFFFAOYSA-N
XLogP1.31
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.84
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-2-chlorophenyl)-1,3-thiazolidine-4-carboxamide
CID 62908918
(4S)-N-(2-chlorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119261984
2-[[2-chloro-5-(methanesulfonamido)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 60942174
N-(2-chloro-4-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 43122672
N-[4-chloro-3-(methylcarbamoyl)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119297598
(3S)-N-[2-chloro-5-(methanesulfonamido)phenyl]piperidine-3-carboxamide
CID 81118445
4-amino-N-[2-chloro-5-(methanesulfonamido)phenyl]cyclopent-2-ene-1-carboxamide
CID 79209278
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-(3-methylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 54862152
N-(2-bromo-3-chlorophenyl)-1,3-thiazolidine-4-carboxamide
CID 103479490
N-[3-chloro-2-(dimethylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43697653

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide (CID 43706823) is N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide is CS(=O)(=O)Nc1ccc(Cl)c(NC(=O)C2CSCN2)c1.
What is the InChIKey of N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is KWKITHCFWMKDOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O3S2/c1-20(17,18)15-7-2-3-8(12)9(4-7)14-11(16)10-5-19-6-13-10/h2-4,10,13,15H,5-6H2,1H3,(H,14,16).
What are the key properties of N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide?
N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 335.84 g/mol, XLogP of 1.31, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(methanesulfonamido)phenyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 43706823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).