4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide

C23H23ClN4O2S — CID 118200706

IUPAC4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide
SMILESCc1cncc(-c2cc3c(Cl)ccc(NS(=O)(=O)c4ccc(C(C)(C)C)cc4)n3n2)c1
InChIInChI=1S/C23H23ClN4O2S/c1-15-11-16(14-25-13-15)20-12-21-19(24)9-10-22(28(21)26-20)27-31(29,30)18-7-5-17(6-8-18)23(2,3)4/h5-14,27H,1-4H3
InChIKeyINEYPNRNXAGIHQ-UHFFFAOYSA-N
MW454.98 g/mol
LogP5.46
Rot. Bonds4

About 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide

4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide (PubChem CID 118200706) has the molecular formula C23H23ClN4O2S and a molecular weight of 454.98 g/mol. Its IUPAC name is 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide
PubChem CID118200706
Molecular FormulaC23H23ClN4O2S
Molecular Weight454.98 g/mol
Exact Mass454.12
IUPAC Name4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide
SMILESCc1cncc(-c2cc3c(Cl)ccc(NS(=O)(=O)c4ccc(C(C)(C)C)cc4)n3n2)c1
InChIInChI=1S/C23H23ClN4O2S/c1-15-11-16(14-25-13-15)20-12-21-19(24)9-10-22(28(21)26-20)27-31(29,30)18-7-5-17(6-8-18)23(2,3)4/h5-14,27H,1-4H3
InChIKeyINEYPNRNXAGIHQ-UHFFFAOYSA-N
XLogP5.46
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.98
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-bromo-2-pyridin-3-ylpyrazolo[1,5-a]pyridin-7-yl)-4-tert-butylbenzenesulfonamide
CID 118197595
4-tert-butyl-N-(4-cyano-2-pyridin-3-ylpyrazolo[1,5-a]pyridin-7-yl)benzenesulfonamide
CID 118200679
4-tert-butyl-N-(2-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide
CID 118200646
4-tert-butyl-N-(4-chloro-2-phenylpyrazolo[1,5-a]pyridin-7-yl)cyclohexa-1,3-diene-1-sulfonamide
CID 123487718
4-tert-butyl-N-[3-(4-chlorophenyl)-1-methylpyrazol-5-yl]benzenesulfonamide
CID 3781906
4-tert-butyl-N-[2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]benzenesulfonamide
CID 118200756
3,4-dichloro-N-(5-methyl-3-pyridinyl)benzenesulfonamide
CID 110727340
N-(4-tert-butylphenyl)sulfanyl-4-chloro-2-(1,5-dimethylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-7-amine
CID 144874972
N-[4-chloro-2-(4-oxocyclohepta-1,6-dien-1-yl)pyrazolo[1,5-a]pyridin-7-yl]-4-(trifluoromethoxy)benzenesulfonamide
CID 123648245
4-tert-butyl-N-[7-chloro-2-[(5-hydroxy-3-pyridinyl)methyl]-1,3-dioxoisoindol-4-yl]benzenesulfonamide
CID 144874800
N-(2-benzyl-5-methylpyrazol-3-yl)-4-tert-butylbenzenesulfonamide
CID 39854251
4-hydroxy-N-(5-methyl-3-pyridinyl)benzenesulfonamide
CID 107585953

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide?
The IUPAC name of 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide (CID 118200706) is 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide.
What is the SMILES notation for 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide?
The canonical SMILES for 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide is Cc1cncc(-c2cc3c(Cl)ccc(NS(=O)(=O)c4ccc(C(C)(C)C)cc4)n3n2)c1.
What is the InChIKey of 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide?
The InChIKey is INEYPNRNXAGIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN4O2S/c1-15-11-16(14-25-13-15)20-12-21-19(24)9-10-22(28(21)26-20)27-31(29,30)18-7-5-17(6-8-18)23(2,3)4/h5-14,27H,1-4H3.
What are the key properties of 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide?
4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide has a molecular weight of 454.98 g/mol, XLogP of 5.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[4-chloro-2-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]benzenesulfonamide is sourced from PubChem (CID 118200706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).