8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide

C17H14Cl2FN3O4S — CID 123742020

IUPAC8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(Cl)c(S(=O)(=O)NC(=O)c2cn3cc(C(C)F)cc(Cl)c3n2)c1
InChIInChI=1S/C17H14Cl2FN3O4S/c1-9(20)10-5-13(19)16-21-14(8-23(16)7-10)17(24)22-28(25,26)15-6-11(27-2)3-4-12(15)18/h3-9H,1-2H3,(H,22,24)
InChIKeyGFFIFUDRFVYQNT-UHFFFAOYSA-N
MW446.29 g/mol
LogP3.80
Rot. Bonds5

About 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide

8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 123742020) has the molecular formula C17H14Cl2FN3O4S and a molecular weight of 446.29 g/mol. Its IUPAC name is 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID123742020
Molecular FormulaC17H14Cl2FN3O4S
Molecular Weight446.29 g/mol
Exact Mass445.01
IUPAC Name8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(Cl)c(S(=O)(=O)NC(=O)c2cn3cc(C(C)F)cc(Cl)c3n2)c1
InChIInChI=1S/C17H14Cl2FN3O4S/c1-9(20)10-5-13(19)16-21-14(8-23(16)7-10)17(24)22-28(25,26)15-6-11(27-2)3-4-12(15)18/h3-9H,1-2H3,(H,22,24)
InChIKeyGFFIFUDRFVYQNT-UHFFFAOYSA-N
XLogP3.80
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.29
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide with MolForge

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Related Compounds

Fluazaindolizine
CID 46944253
3-[3-(5-Chloro-2-methoxypyridine-3-sulfonamido)-2,6-difluorophenyl]-N-methylimidazo[1,5-a]pyrimidine-8-carboxamide
CID 164593750
6-chloro-N-(4-methoxybenzyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42535023
6-chloro-N-(2-methoxybenzyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42536678
6-Chloro-N-[(3-methoxyphenyl)methyl]imidazo[1,2-A]pyridine-2-carboxamide
CID 87051334
CID 134789346
CID 134789346
CID 134789881
CID 134789881
8-chloro-N-(5-methoxy-2-nitrophenyl)sulfonyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 49818962
8-bromo-N-[(2-chloro-5-methoxyphenyl)sulfonyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 49818965
N-[(2-chloro-5-methoxyphenyl)sulfonyl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine-2-carboxamide
CID 56952251
N-[5-[2-(difluoromethyl)-6-oxo-1-propyl-7H-purin-8-yl]pyridin-2-yl]-3-methoxybenzenesulfonamide
CID 67134907
8-chloro-N-[(2-chloro-5-methoxyphenyl)sulfonyl]-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 67494733

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 123742020) is 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide is COc1ccc(Cl)c(S(=O)(=O)NC(=O)c2cn3cc(C(C)F)cc(Cl)c3n2)c1.
What is the InChIKey of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is GFFIFUDRFVYQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2FN3O4S/c1-9(20)10-5-13(19)16-21-14(8-23(16)7-10)17(24)22-28(25,26)15-6-11(27-2)3-4-12(15)18/h3-9H,1-2H3,(H,22,24).
What are the key properties of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide?
8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 446.29 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(1-fluoroethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 123742020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).