7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine

C20H16N2O4S — CID 170785545

IUPAC7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine
SMILESCOc1cc(-c2ccnc3cc(-c4ccc(S(C)(=O)=O)cc4)oc23)ccn1
InChIInChI=1S/C20H16N2O4S/c1-25-19-11-14(7-9-22-19)16-8-10-21-17-12-18(26-20(16)17)13-3-5-15(6-4-13)27(2,23)24/h3-12H,1-2H3
InChIKeyXGSVZGACKRWEJG-UHFFFAOYSA-N
MW380.43 g/mol
LogP3.97
Rot. Bonds4

About 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine

7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine (PubChem CID 170785545) has the molecular formula C20H16N2O4S and a molecular weight of 380.43 g/mol. Its IUPAC name is 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine.

Molecular Properties

Compound Name7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine
PubChem CID170785545
Molecular FormulaC20H16N2O4S
Molecular Weight380.43 g/mol
Exact Mass380.08
IUPAC Name7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine
SMILESCOc1cc(-c2ccnc3cc(-c4ccc(S(C)(=O)=O)cc4)oc23)ccn1
InChIInChI=1S/C20H16N2O4S/c1-25-19-11-14(7-9-22-19)16-8-10-21-17-12-18(26-20(16)17)13-3-5-15(6-4-13)27(2,23)24/h3-12H,1-2H3
InChIKeyXGSVZGACKRWEJG-UHFFFAOYSA-N
XLogP3.97
TPSA82.29 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.43
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine
CID 66779809
N-(2-hydroxyethyl)-4-[2-(4-methylsulfonylphenyl)furo[3,2-b]pyridin-7-yl]pyridine-2-carboxamide
CID 170785503
2-[1-[4-[2-(4-methylsulfonylphenyl)furo[3,2-b]pyridin-7-yl]-2-pyridinyl]piperidin-4-yl]propan-2-ol
CID 170785472
2-(4-methylsulfonylphenyl)-7-[2-[(1R,4R)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]-4-pyridinyl]furo[3,2-b]pyridine
CID 170785489
2-[4-[2-(2-methyl-4-methylsulfonylphenyl)furo[3,2-b]pyridin-7-yl]-2-pyridinyl]propan-2-ol
CID 170785473
[3-[2-(4-methylsulfonylphenyl)furo[3,2-b]pyridin-7-yl]phenyl]-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 170785546
[2-fluoro-5-[2-(4-methylsulfonylphenyl)furo[3,2-b]pyridin-7-yl]phenyl]-(2-oxa-5-azabicyclo[2.2.0]hexan-5-yl)methanone
CID 170785203
[3-[2-(4-methylsulfonylphenyl)furo[3,2-b]pyridin-7-yl]phenyl]-(2-oxa-7-azaspiro[3.4]octan-7-yl)methanone
CID 170785480
2-[4-[2-[4-[(R)-methylsulfinyl]phenyl]furo[3,2-b]pyridin-7-yl]-2-pyridinyl]propan-2-ol
CID 170785225
7-(3-methylphenyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine
CID 118011717
N,N-dimethyl-3-[2-(6-methylsulfonyl-3-pyridinyl)furo[3,2-b]pyridin-7-yl]benzamide
CID 170785533
7-quinolin-6-yl-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine
CID 66779212

Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine?
The IUPAC name of 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine (CID 170785545) is 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine.
What is the SMILES notation for 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine?
The canonical SMILES for 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine is COc1cc(-c2ccnc3cc(-c4ccc(S(C)(=O)=O)cc4)oc23)ccn1.
What is the InChIKey of 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine?
The InChIKey is XGSVZGACKRWEJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O4S/c1-25-19-11-14(7-9-22-19)16-8-10-21-17-12-18(26-20(16)17)13-3-5-15(6-4-13)27(2,23)24/h3-12H,1-2H3.
What are the key properties of 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine?
7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine has a molecular weight of 380.43 g/mol, XLogP of 3.97, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxy-4-pyridinyl)-2-(4-methylsulfonylphenyl)furo[3,2-b]pyridine is sourced from PubChem (CID 170785545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).