4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide

C72H68BrF5N20O12S5 — CID 159621685

IUPAC4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide
SMILESCc1cc2nccc(NS(=O)(=O)c3ccc(Br)cc3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3ccc(OC(F)F)cc3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3cccc(C(C)(C)C)c3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3cccc(OC(F)(F)F)c3)n2n1.Cc1ccc(S(=O)(=O)Nc2ccnc3cc(C)nn23)cc1
InChIInChI=1S/C17H20N4O2S.C14H11F3N4O3S.C14H12F2N4O3S.C14H14N4O2S.C13H11BrN4O2S/c1-12-10-16-18-9-8-15(21(16)19-12)20-24(22,23)14-7-5-6-13(11-14)17(2,3)4;1-9-7-13-18-6-5-12(21(13)19-9)20-25(22,23)11-4-2-3-10(8-11)24-14(15,16)17;1-9-8-13-17-7-6-12(20(13)18-9)19-24(21,22)11-4-2-10(3-5-11)23-14(15)16;1-10-3-5-12(6-4-10)21(19,20)17-13-7-8-15-14-9-11(2)16-18(13)14;1-9-8-13-15-7-6-12(18(13)16-9)17-21(19,20)11-4-2-10(14)3-5-11/h5-11,20H,1-4H3;2-8,20H,1H3;2-8,14,19H,1H3;3-9,17H,1-2H3;2-8,17H,1H3
InChIKeyMNYWYELWTIBATE-UHFFFAOYSA-N
MW1740.69 g/mol
LogP13.06
Rot. Bonds18

About 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide

4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide (PubChem CID 159621685) has the molecular formula C72H68BrF5N20O12S5 and a molecular weight of 1740.69 g/mol. Its IUPAC name is 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide.

Molecular Properties

Compound Name4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide
PubChem CID159621685
Molecular FormulaC72H68BrF5N20O12S5
Molecular Weight1740.69 g/mol
Exact Mass1738.30
IUPAC Name4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide
SMILESCc1cc2nccc(NS(=O)(=O)c3ccc(Br)cc3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3ccc(OC(F)F)cc3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3cccc(C(C)(C)C)c3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3cccc(OC(F)(F)F)c3)n2n1.Cc1ccc(S(=O)(=O)Nc2ccnc3cc(C)nn23)cc1
InChIInChI=1S/C17H20N4O2S.C14H11F3N4O3S.C14H12F2N4O3S.C14H14N4O2S.C13H11BrN4O2S/c1-12-10-16-18-9-8-15(21(16)19-12)20-24(22,23)14-7-5-6-13(11-14)17(2,3)4;1-9-7-13-18-6-5-12(21(13)19-9)20-25(22,23)11-4-2-3-10(8-11)24-14(15,16)17;1-9-8-13-17-7-6-12(20(13)18-9)19-24(21,22)11-4-2-10(3-5-11)23-14(15)16;1-10-3-5-12(6-4-10)21(19,20)17-13-7-8-15-14-9-11(2)16-18(13)14;1-9-8-13-15-7-6-12(18(13)16-9)17-21(19,20)11-4-2-10(14)3-5-11/h5-11,20H,1-4H3;2-8,20H,1H3;2-8,14,19H,1H3;3-9,17H,1-2H3;2-8,17H,1H3
InChIKeyMNYWYELWTIBATE-UHFFFAOYSA-N
XLogP13.06
TPSA400.26 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds18
Heavy Atoms115
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001740.69
LogP ≤ 513.06
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide with MolForge

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Related Compounds

6-[[5-Bromo-6-(4-methylpyrazol-1-yl)-2-pyridinyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;6-[[4-(1,1-difluoroethyl)-3-methoxyphenyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;6-[[4-(1,1-difluoroethylsulfinyl)phenyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;methane;5-methyl-6-[[4-(trifluoromethylsulfonyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 158029600
6-[[5-Bromo-6-(4-methylpyrazol-1-yl)-2-pyridinyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;6-[[4-(1,1-difluoroethyl)-3-methoxyphenyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;6-[[4-(1,1-difluoroethylsulfinyl)phenyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;6-[[4-(1-fluoroethoxy)phenyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine;methane;5-methyl-6-[[4-(trifluoromethylsulfonyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 158495687
3-tert-butyl-N-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)-4-(difluoromethoxy)benzenesulfonamide;N-(2-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide
CID 161505363
1-[7-(benzenesulfonyl)-6-(1-methylpyrazol-4-yl)pyrrolo[2,3-d]pyrimidin-4-yl]piperidin-4-amine;N-[1-[7-(benzenesulfonyl)-6-(1-methylpyrazol-4-yl)pyrrolo[2,3-d]pyrimidin-4-yl]piperidin-4-yl]-4-(trifluoromethoxy)benzenesulfonamide;N-[1-[6-(1-methylpyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidin-4-yl]-4-(trifluoromethoxy)benzenesulfonamide;4-(trifluoromethoxy)benzenesulfonyl chloride
CID 161601693
5-bromo-1-(4-methylphenyl)sulfonylpyrazolo[3,4-b]pyridine;3-bromo-7H-pyrrolo[3,4-b]pyridine;3-iodo-1-[(4-methoxyphenyl)methyl]-5-(2-methyl-4-pyridinyl)pyrazolo[5,4-b]pyridine;5-iodo-3-(2-methyl-4-pyridinyl)-7H-pyrrolo[3,4-b]pyridine;1-(4-methylphenyl)sulfonyl-5-(2-methyl-4-pyridinyl)pyrazolo[3,4-b]pyridine;3-(2-methyl-4-pyridinyl)-7H-pyrrolo[3,4-b]pyridine
CID 157684649
N-[4-(4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenyl]-3-(4-fluorophenoxy)benzenesulfonamide;N-[4-(4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenyl]-4-(4-fluorophenoxy)benzenesulfonamide;N-[4-(4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenyl]-3-phenylbenzenesulfonamide;N-[4-(4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenyl]-4-pyridin-4-yloxybenzenesulfonamide
CID 160307051

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide?
The IUPAC name of 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide (CID 159621685) is 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide.
What is the SMILES notation for 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide?
The canonical SMILES for 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide is Cc1cc2nccc(NS(=O)(=O)c3ccc(Br)cc3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3ccc(OC(F)F)cc3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3cccc(C(C)(C)C)c3)n2n1.Cc1cc2nccc(NS(=O)(=O)c3cccc(OC(F)(F)F)c3)n2n1.Cc1ccc(S(=O)(=O)Nc2ccnc3cc(C)nn23)cc1.
What is the InChIKey of 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide?
The InChIKey is MNYWYELWTIBATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2S.C14H11F3N4O3S.C14H12F2N4O3S.C14H14N4O2S.C13H11BrN4O2S/c1-12-10-16-18-9-8-15(21(16)19-12)20-24(22,23)14-7-5-6-13(11-14)17(2,3)4;1-9-7-13-18-6-5-12(21(13)19-9)20-25(22,23)11-4-2-3-10(8-11)24-14(15,16)17;1-9-8-13-17-7-6-12(20(13)18-9)19-24(21,22)11-4-2-10(3-5-11)23-14(15)16;1-10-3-5-12(6-4-10)21(19,20)17-13-7-8-15-14-9-11(2)16-18(13)14;1-9-8-13-15-7-6-12(18(13)16-9)17-21(19,20)11-4-2-10(14)3-5-11/h5-11,20H,1-4H3;2-8,20H,1H3;2-8,14,19H,1H3;3-9,17H,1-2H3;2-8,17H,1H3.
What are the key properties of 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide?
4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide has a molecular weight of 1740.69 g/mol, XLogP of 13.06, 18 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;3-tert-butyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-(difluoromethoxy)-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;4-methyl-N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)benzenesulfonamide;N-(2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-3-(trifluoromethoxy)benzenesulfonamide is sourced from PubChem (CID 159621685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).