N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide

C24H22ClN7O3S — CID 139487552

IUPACN-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide
SMILESCS(=O)(=O)c1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)cc45)cn3)nc12
InChIInChI=1S/C24H22ClN7O3S/c1-36(34,35)22-6-16(15-2-3-15)10-31-12-19(29-23(22)31)13-32-11-17(8-28-32)24(33)26-9-20-21-7-18(25)4-5-30(21)14-27-20/h4-8,10-12,14-15H,2-3,9,13H2,1H3,(H,26,33)
InChIKeyJXYCVCMSYBYHLY-UHFFFAOYSA-N
MW524.01 g/mol
LogP3.09
Rot. Bonds7

About N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide

N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide (PubChem CID 139487552) has the molecular formula C24H22ClN7O3S and a molecular weight of 524.01 g/mol. Its IUPAC name is N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide
PubChem CID139487552
Molecular FormulaC24H22ClN7O3S
Molecular Weight524.01 g/mol
Exact Mass523.12
IUPAC NameN-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide
SMILESCS(=O)(=O)c1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)cc45)cn3)nc12
InChIInChI=1S/C24H22ClN7O3S/c1-36(34,35)22-6-16(15-2-3-15)10-31-12-19(29-23(22)31)13-32-11-17(8-28-32)24(33)26-9-20-21-7-18(25)4-5-30(21)14-27-20/h4-8,10-12,14-15H,2-3,9,13H2,1H3,(H,26,33)
InChIKeyJXYCVCMSYBYHLY-UHFFFAOYSA-N
XLogP3.09
TPSA115.66 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500524.01
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide?
The IUPAC name of N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide (CID 139487552) is N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide.
What is the SMILES notation for N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide?
The canonical SMILES for N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide is CS(=O)(=O)c1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)cc45)cn3)nc12.
What is the InChIKey of N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide?
The InChIKey is JXYCVCMSYBYHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22ClN7O3S/c1-36(34,35)22-6-16(15-2-3-15)10-31-12-19(29-23(22)31)13-32-11-17(8-28-32)24(33)26-9-20-21-7-18(25)4-5-30(21)14-27-20/h4-8,10-12,14-15H,2-3,9,13H2,1H3,(H,26,33).
What are the key properties of N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide?
N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide has a molecular weight of 524.01 g/mol, XLogP of 3.09, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-methylsulfonylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxamide is sourced from PubChem (CID 139487552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).