7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C19H14Cl2N6O3S — CID 84569209

IUPAC7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2cc(Cl)ccn2c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1
InChIInChI=1S/C19H14Cl2N6O3S/c1-11-18(27-9-8-12(20)10-17(27)22-11)19(28)23-13-2-4-14(5-3-13)31(29,30)26-16-7-6-15(21)24-25-16/h2-10H,1H3,(H,23,28)(H,25,26)
InChIKeyPXTBJGDYAWUHIK-UHFFFAOYSA-N
MW477.33 g/mol
LogP3.79
Rot. Bonds5

About 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 84569209) has the molecular formula C19H14Cl2N6O3S and a molecular weight of 477.33 g/mol. Its IUPAC name is 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID84569209
Molecular FormulaC19H14Cl2N6O3S
Molecular Weight477.33 g/mol
Exact Mass476.02
IUPAC Name7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2cc(Cl)ccn2c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1
InChIInChI=1S/C19H14Cl2N6O3S/c1-11-18(27-9-8-12(20)10-17(27)22-11)19(28)23-13-2-4-14(5-3-13)31(29,30)26-16-7-6-15(21)24-25-16/h2-10H,1H3,(H,23,28)(H,25,26)
InChIKeyPXTBJGDYAWUHIK-UHFFFAOYSA-N
XLogP3.79
TPSA118.35 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.33
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 84569209) is 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2cc(Cl)ccn2c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1.
What is the InChIKey of 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is PXTBJGDYAWUHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N6O3S/c1-11-18(27-9-8-12(20)10-17(27)22-11)19(28)23-13-2-4-14(5-3-13)31(29,30)26-16-7-6-15(21)24-25-16/h2-10H,1H3,(H,23,28)(H,25,26).
What are the key properties of 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 477.33 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 84569209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).