8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

C17H12Cl2F3N3O4S — CID 67494733

IUPAC8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(Cl)c(S(=O)(=O)NC(=O)c2nc3c(Cl)cc(C(F)(F)F)cn3c2C)c1
InChIInChI=1S/C17H12Cl2F3N3O4S/c1-8-14(23-15-12(19)5-9(7-25(8)15)17(20,21)22)16(26)24-30(27,28)13-6-10(29-2)3-4-11(13)18/h3-7H,1-2H3,(H,24,26)
InChIKeySSWSPKNBPPHNGG-UHFFFAOYSA-N
MW482.27 g/mol
LogP4.10
Rot. Bonds4

About 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 67494733) has the molecular formula C17H12Cl2F3N3O4S and a molecular weight of 482.27 g/mol. Its IUPAC name is 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID67494733
Molecular FormulaC17H12Cl2F3N3O4S
Molecular Weight482.27 g/mol
Exact Mass480.99
IUPAC Name8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(Cl)c(S(=O)(=O)NC(=O)c2nc3c(Cl)cc(C(F)(F)F)cn3c2C)c1
InChIInChI=1S/C17H12Cl2F3N3O4S/c1-8-14(23-15-12(19)5-9(7-25(8)15)17(20,21)22)16(26)24-30(27,28)13-6-10(29-2)3-4-11(13)18/h3-7H,1-2H3,(H,24,26)
InChIKeySSWSPKNBPPHNGG-UHFFFAOYSA-N
XLogP4.10
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.27
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 46944253
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6-chloro-N,N-dimethyl-3-({[2-(trifluoromethoxy)benzyl]amino}methyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 16187296
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CID 134789346
CID 134789346
8-chloro-N-(5-methoxy-2-nitrophenyl)sulfonyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 49818962
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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
N-(benzenesulfonyl)-8-chloro-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 68082273
1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-[4-(trifluoromethoxy)phenyl]sulfonylpyrrole-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 67494733) is 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is COc1ccc(Cl)c(S(=O)(=O)NC(=O)c2nc3c(Cl)cc(C(F)(F)F)cn3c2C)c1.
What is the InChIKey of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is SSWSPKNBPPHNGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2F3N3O4S/c1-8-14(23-15-12(19)5-9(7-25(8)15)17(20,21)22)16(26)24-30(27,28)13-6-10(29-2)3-4-11(13)18/h3-7H,1-2H3,(H,24,26).
What are the key properties of 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 482.27 g/mol, XLogP of 4.10, 4 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-3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 67494733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).