N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide

C18H15F3N6O3S — CID 170964743

IUPACN-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
SMILESCOc1ccc2cn(C)nc2c1NS(=O)(=O)c1ccc(-n2cc(C(F)(F)F)cn2)nc1
InChIInChI=1S/C18H15F3N6O3S/c1-26-9-11-3-5-14(30-2)17(16(11)24-26)25-31(28,29)13-4-6-15(22-8-13)27-10-12(7-23-27)18(19,20)21/h3-10,25H,1-2H3
InChIKeyPKDAEDNXRQYKMZ-UHFFFAOYSA-N
MW452.42 g/mol
LogP2.98
Rot. Bonds5

About N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide

N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide (PubChem CID 170964743) has the molecular formula C18H15F3N6O3S and a molecular weight of 452.42 g/mol. Its IUPAC name is N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
PubChem CID170964743
Molecular FormulaC18H15F3N6O3S
Molecular Weight452.42 g/mol
Exact Mass452.09
IUPAC NameN-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
SMILESCOc1ccc2cn(C)nc2c1NS(=O)(=O)c1ccc(-n2cc(C(F)(F)F)cn2)nc1
InChIInChI=1S/C18H15F3N6O3S/c1-26-9-11-3-5-14(30-2)17(16(11)24-26)25-31(28,29)13-4-6-15(22-8-13)27-10-12(7-23-27)18(19,20)21/h3-10,25H,1-2H3
InChIKeyPKDAEDNXRQYKMZ-UHFFFAOYSA-N
XLogP2.98
TPSA103.93 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.42
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

6-methoxy-2-methyl-N-[[6-[4-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]sulfanyl]indazol-7-amine
CID 170964674
N-(1,6-dimethylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 170965119
N-(1,5-dimethylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 171463665
6-(4-chloropyrazol-1-yl)-N-(6-methoxy-1-methylindazol-7-yl)pyridine-3-sulfonamide
CID 170965058
6-[4-(1-hydroxyethyl)pyrazol-1-yl]-N-(6-methoxy-1-methylindazol-7-yl)pyridine-3-sulfonamide
CID 170964825
6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 170964811
CID 170964582
CID 170964582
N-[(1S,2R,3R)-2-methyl-3-phenylcyclopropyl]-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 67526456
N-(6-methoxy-1-methylindazol-7-yl)-3-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonamide
CID 170968701
trans-(1S,3R)-2-methyl-3-phenyl-1-[[6-[4-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]sulfonylamino]cyclopropane-1-carboxylic acid;hydrochloride
CID 159806279
[ethenyl-[[6-[4-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]sulfonyl]amino]methylidenenickel
CID 170964550
methyl 6-[4-[(6-methoxy-1-methylindazol-7-yl)sulfamoyl]pyrazol-1-yl]-4-methylpyridine-3-carboxylate
CID 170969296

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
The IUPAC name of N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide (CID 170964743) is N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide is COc1ccc2cn(C)nc2c1NS(=O)(=O)c1ccc(-n2cc(C(F)(F)F)cn2)nc1.
What is the InChIKey of N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
The InChIKey is PKDAEDNXRQYKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F3N6O3S/c1-26-9-11-3-5-14(30-2)17(16(11)24-26)25-31(28,29)13-4-6-15(22-8-13)27-10-12(7-23-27)18(19,20)21/h3-10,25H,1-2H3.
What are the key properties of N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide has a molecular weight of 452.42 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-2-methylindazol-7-yl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 170964743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).