2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide

C19H11Cl2FN4O3S — CID 118033506

IUPAC2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide
SMILESO=C(Nc1cc2c(cn1)cnn2S(=O)(=O)c1ccc(F)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H11Cl2FN4O3S/c20-14-2-1-3-15(21)18(14)19(27)25-17-8-16-11(9-23-17)10-24-26(16)30(28,29)13-6-4-12(22)5-7-13/h1-10H,(H,23,25,27)
InChIKeyVQCJBMGYPODHAJ-UHFFFAOYSA-N
MW465.29 g/mol
LogP4.37
Rot. Bonds4

About 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide

2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide (PubChem CID 118033506) has the molecular formula C19H11Cl2FN4O3S and a molecular weight of 465.29 g/mol. Its IUPAC name is 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide
PubChem CID118033506
Molecular FormulaC19H11Cl2FN4O3S
Molecular Weight465.29 g/mol
Exact Mass463.99
IUPAC Name2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide
SMILESO=C(Nc1cc2c(cn1)cnn2S(=O)(=O)c1ccc(F)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H11Cl2FN4O3S/c20-14-2-1-3-15(21)18(14)19(27)25-17-8-16-11(9-23-17)10-24-26(16)30(28,29)13-6-4-12(22)5-7-13/h1-10H,(H,23,25,27)
InChIKeyVQCJBMGYPODHAJ-UHFFFAOYSA-N
XLogP4.37
TPSA93.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.29
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-N-[1-(3-chlorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]-6-fluorobenzamide
CID 118033522
2-chloro-N-[1-(3-chlorophenyl)sulfonylindazol-6-yl]-6-(trifluoromethyl)benzamide
CID 69282264
2-chloro-N-[1-(4-fluorophenyl)sulfonyl-2-methyl-2,3-dihydropyrido[3,4-b][1,4]oxazin-7-yl]-6-(trifluoromethyl)benzamide
CID 118033552
methyl 4-[6-[2-(2-chloro-6-fluorophenyl)-2-oxoethyl]indazol-1-yl]sulfonylbenzoate
CID 161172445
1-(2-chloro-6-fluorophenyl)-2-[1-[4-(trifluoromethyl)phenyl]sulfonylindazol-6-yl]ethanone
CID 157228939
1-(2-chloro-6-fluorophenyl)-2-[1-(4-chloro-3-fluorophenyl)sulfonylindazol-6-yl]ethanone
CID 161122540
2,6-dichloro-N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]benzamide
CID 69282851
4-[(2,6-dichlorobenzoyl)amino]-N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1H-pyrazole-5-carboxamide
CID 59862699
2,6-dichloro-N-[4-(4-fluorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl]benzamide
CID 90085874
1-(2-chloro-6-fluorophenyl)-2-[1-(2,6-difluorophenyl)sulfonylindazol-6-yl]ethanone
CID 161284199
2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 23440185
2,6-dichloro-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]benzamide
CID 1225286

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide (CID 118033506) is 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide is O=C(Nc1cc2c(cn1)cnn2S(=O)(=O)c1ccc(F)cc1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide?
The InChIKey is VQCJBMGYPODHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl2FN4O3S/c20-14-2-1-3-15(21)18(14)19(27)25-17-8-16-11(9-23-17)10-24-26(16)30(28,29)13-6-4-12(22)5-7-13/h1-10H,(H,23,25,27).
What are the key properties of 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide?
2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide has a molecular weight of 465.29 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[1-(4-fluorophenyl)sulfonylpyrazolo[4,3-c]pyridin-6-yl]benzamide is sourced from PubChem (CID 118033506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).