2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide

C17H10Cl2FN5O3S — CID 167872936

IUPAC2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide
SMILESO=C(NS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1c(Cl)nc2cc(Cl)ccn12
InChIInChI=1S/C17H10Cl2FN5O3S/c18-10-5-6-24-14(7-10)22-16(19)15(24)17(26)23-29(27,28)11-8-21-25(9-11)13-4-2-1-3-12(13)20/h1-9H,(H,23,26)
InChIKeyHVCYYCHUGAHIKS-UHFFFAOYSA-N
MW454.27 g/mol
LogP3.08
Rot. Bonds4

About 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide

2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 167872936) has the molecular formula C17H10Cl2FN5O3S and a molecular weight of 454.27 g/mol. Its IUPAC name is 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID167872936
Molecular FormulaC17H10Cl2FN5O3S
Molecular Weight454.27 g/mol
Exact Mass452.99
IUPAC Name2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide
SMILESO=C(NS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1c(Cl)nc2cc(Cl)ccn12
InChIInChI=1S/C17H10Cl2FN5O3S/c18-10-5-6-24-14(7-10)22-16(19)15(24)17(26)23-29(27,28)11-8-21-25(9-11)13-4-2-1-3-12(13)20/h1-9H,(H,23,26)
InChIKeyHVCYYCHUGAHIKS-UHFFFAOYSA-N
XLogP3.08
TPSA98.36 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.27
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-chloro-4-(difluoromethyl)-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylbenzamide
CID 166365928
1-(2-fluorophenyl)-N-(3-hydroxy-5-methoxyphenyl)pyrazole-4-sulfonamide
CID 100680192
1-(2-fluorophenyl)-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pyrazole-4-sulfonamide
CID 166215188
1-(2-fluorophenyl)-N-[4-(methylsulfamoyl)phenyl]pyrazole-4-carboxamide
CID 95348121
1-(2-fluorophenyl)-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrazole-4-sulfonamide
CID 167978297
7-chloro-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 82530149
2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide
CID 166234236
N-(2,5-dichlorophenyl)sulfonyl-1-(2-fluorophenyl)imidazole-4-carboxamide
CID 139453060
1-(2-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-sulfonamide
CID 119974341
N-(3,5-difluorophenyl)-1-(2-fluorophenyl)pyrazole-4-carboxamide
CID 94828526
N-(2-amino-1-cyclohexylethyl)-1-(2-fluorophenyl)pyrazole-4-sulfonamide
CID 119983754
1-(2-fluorophenyl)-N-(2-methylpiperidin-4-yl)pyrazole-4-sulfonamide;hydrochloride
CID 120586182

Frequently Asked Questions

What is the IUPAC name of 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide (CID 167872936) is 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide is O=C(NS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1c(Cl)nc2cc(Cl)ccn12.
What is the InChIKey of 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is HVCYYCHUGAHIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10Cl2FN5O3S/c18-10-5-6-24-14(7-10)22-16(19)15(24)17(26)23-29(27,28)11-8-21-25(9-11)13-4-2-1-3-12(13)20/h1-9H,(H,23,26).
What are the key properties of 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide?
2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 454.27 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dichloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]sulfonylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 167872936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).