1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine

C23H18FN7O2S — CID 146639059

IUPAC1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine
SMILESCn1cc(-c2cnc3cnn(S(=O)(=O)C4CN=C5C=CC(c6cccc(F)c6)=CN54)c3c2)cn1
InChIInChI=1S/C23H18FN7O2S/c1-29-13-18(10-27-29)17-8-21-20(25-9-17)11-28-31(21)34(32,33)23-12-26-22-6-5-16(14-30(22)23)15-3-2-4-19(24)7-15/h2-11,13-14,23H,12H2,1H3
InChIKeyJVKPSKFYPHVFNY-UHFFFAOYSA-N
MW475.51 g/mol
LogP2.80
Rot. Bonds4

About 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine

1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine (PubChem CID 146639059) has the molecular formula C23H18FN7O2S and a molecular weight of 475.51 g/mol. Its IUPAC name is 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine
PubChem CID146639059
Molecular FormulaC23H18FN7O2S
Molecular Weight475.51 g/mol
Exact Mass475.12
IUPAC Name1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine
SMILESCn1cc(-c2cnc3cnn(S(=O)(=O)C4CN=C5C=CC(c6cccc(F)c6)=CN54)c3c2)cn1
InChIInChI=1S/C23H18FN7O2S/c1-29-13-18(10-27-29)17-8-21-20(25-9-17)11-28-31(21)34(32,33)23-12-26-22-6-5-16(14-30(22)23)15-3-2-4-19(24)7-15/h2-11,13-14,23H,12H2,1H3
InChIKeyJVKPSKFYPHVFNY-UHFFFAOYSA-N
XLogP2.80
TPSA98.27 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.51
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine?
The IUPAC name of 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine (CID 146639059) is 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine?
The canonical SMILES for 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine is Cn1cc(-c2cnc3cnn(S(=O)(=O)C4CN=C5C=CC(c6cccc(F)c6)=CN54)c3c2)cn1.
What is the InChIKey of 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine?
The InChIKey is JVKPSKFYPHVFNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN7O2S/c1-29-13-18(10-27-29)17-8-21-20(25-9-17)11-28-31(21)34(32,33)23-12-26-22-6-5-16(14-30(22)23)15-3-2-4-19(24)7-15/h2-11,13-14,23H,12H2,1H3.
What are the key properties of 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine?
1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine has a molecular weight of 475.51 g/mol, XLogP of 2.80, 4 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[6-(3-fluorophenyl)-2,3-dihydroimidazo[1,2-a]pyridin-3-yl]sulfonyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 146639059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).