N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide

C19H17F3N6O4S — CID 170968893

IUPACN-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
SMILESCOc1cnc(C(F)(F)F)cc1-n1cc(S(=O)(=O)Nc2c(OC)ccc3cnn(C)c23)cn1
InChIInChI=1S/C19H17F3N6O4S/c1-27-18-11(7-24-27)4-5-14(31-2)17(18)26-33(29,30)12-8-25-28(10-12)13-6-16(19(20,21)22)23-9-15(13)32-3/h4-10,26H,1-3H3
InChIKeyGWCKPSIKVRSMMM-UHFFFAOYSA-N
MW482.44 g/mol
LogP2.99
Rot. Bonds6

About N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide

N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide (PubChem CID 170968893) has the molecular formula C19H17F3N6O4S and a molecular weight of 482.44 g/mol. Its IUPAC name is N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
PubChem CID170968893
Molecular FormulaC19H17F3N6O4S
Molecular Weight482.44 g/mol
Exact Mass482.10
IUPAC NameN-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
SMILESCOc1cnc(C(F)(F)F)cc1-n1cc(S(=O)(=O)Nc2c(OC)ccc3cnn(C)c23)cn1
InChIInChI=1S/C19H17F3N6O4S/c1-27-18-11(7-24-27)4-5-14(31-2)17(18)26-33(29,30)12-8-25-28(10-12)13-6-16(19(20,21)22)23-9-15(13)32-3/h4-10,26H,1-3H3
InChIKeyGWCKPSIKVRSMMM-UHFFFAOYSA-N
XLogP2.99
TPSA113.16 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.44
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

N-(6-methoxy-1-methylindazol-7-yl)-3-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonamide
CID 170968701
1-[4-(3-fluoro-3-methylazetidin-1-yl)-2-pyridinyl]-N-(6-methoxy-1-methylindazol-7-yl)pyrazole-4-sulfonamide
CID 170968733
N-(6-methoxy-1-methylindazol-7-yl)-1-[6-(trifluoromethyl)pyrimidin-4-yl]pyrazole-4-sulfonamide
CID 170968752
N-(6-methoxy-1-methylindazol-7-yl)-5-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonamide
CID 170968855
N-(6-ethoxy-1-methylindazol-7-yl)-1-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
CID 170968859
N-(6-methoxy-2-methylindazol-7-yl)-1-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
CID 170968870
1-[4-(difluoromethyl)-2-pyridinyl]-N-(6-methoxy-1-methylindazol-7-yl)pyrazole-4-sulfonamide
CID 170968904
N-(6-methoxy-1-methylindazol-7-yl)-N-methyl-1-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
CID 170968922
N-(6-methoxy-1-methylindazol-7-yl)-1-[4-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonamide
CID 170968930
N-(1-methyl-6-propan-2-yloxyindazol-7-yl)-1-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide
CID 170968997
N-(6-methoxy-1-methylindazol-7-yl)-1-[5-(trifluoromethyl)-3-pyridinyl]pyrazole-4-sulfonamide
CID 170969000
N-(6-methoxy-1-methylindazol-7-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonamide
CID 170969019

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide?
The IUPAC name of N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide (CID 170968893) is N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide.
What is the SMILES notation for N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide?
The canonical SMILES for N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide is COc1cnc(C(F)(F)F)cc1-n1cc(S(=O)(=O)Nc2c(OC)ccc3cnn(C)c23)cn1.
What is the InChIKey of N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide?
The InChIKey is GWCKPSIKVRSMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N6O4S/c1-27-18-11(7-24-27)4-5-14(31-2)17(18)26-33(29,30)12-8-25-28(10-12)13-6-16(19(20,21)22)23-9-15(13)32-3/h4-10,26H,1-3H3.
What are the key properties of N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide?
N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide has a molecular weight of 482.44 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-1-methylindazol-7-yl)-1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-sulfonamide is sourced from PubChem (CID 170968893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).