1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol

C22H17NO3S — CID 118720466

IUPAC1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol
SMILESCOc1ccccc1S(=O)c1c(O)c(-c2cccnc2)cc2ccccc12
InChIInChI=1S/C22H17NO3S/c1-26-19-10-4-5-11-20(19)27(25)22-17-9-3-2-7-15(17)13-18(21(22)24)16-8-6-12-23-14-16/h2-14,24H,1H3
InChIKeyIQZIVGDAZLAQRM-UHFFFAOYSA-N
MW375.45 g/mol
LogP4.78
Rot. Bonds4

About 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol

1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol (PubChem CID 118720466) has the molecular formula C22H17NO3S and a molecular weight of 375.45 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol.

Molecular Properties

Compound Name1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol
PubChem CID118720466
Molecular FormulaC22H17NO3S
Molecular Weight375.45 g/mol
Exact Mass375.09
IUPAC Name1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol
SMILESCOc1ccccc1S(=O)c1c(O)c(-c2cccnc2)cc2ccccc12
InChIInChI=1S/C22H17NO3S/c1-26-19-10-4-5-11-20(19)27(25)22-17-9-3-2-7-15(17)13-18(21(22)24)16-8-6-12-23-14-16/h2-14,24H,1H3
InChIKeyIQZIVGDAZLAQRM-UHFFFAOYSA-N
XLogP4.78
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-pyridin-3-yl-1-[4-(trifluoromethoxy)phenyl]sulfinylnaphthalen-2-ol
CID 118720472
4-(2-hydroxy-3-pyridin-3-ylnaphthalen-1-yl)sulfinylbenzonitrile
CID 118720478
3-(2-methoxyphenyl)pyridine
CID 4133297
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
CID 156631933
3-(2,3-dimethoxyphenyl)pyridine
CID 22001178
8,11-dimethoxy-6-pyridin-3-ylbenzimidazolo[2,1-a]isoquinoline
CID 146168129
methyl 4-methoxy-3-pyridin-3-ylbenzoate
CID 46317451
3-(3,4,5-trimethoxyphenyl)pyridine
CID 141070241
3-(2,4-dimethoxyphenyl)pyridine
CID 46316965
3-(2-methoxy-3-pyridin-3-ylphenyl)pyridine
CID 46316374
2-(2-methoxyphenyl)-N-[(5-pyridin-3-yl-3-pyridinyl)methyl]acetamide
CID 131702715
2-chloro-4-methoxy-5-pyridin-3-ylpyridine
CID 175166261

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol?
The IUPAC name of 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol (CID 118720466) is 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol.
What is the SMILES notation for 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol?
The canonical SMILES for 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol is COc1ccccc1S(=O)c1c(O)c(-c2cccnc2)cc2ccccc12.
What is the InChIKey of 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol?
The InChIKey is IQZIVGDAZLAQRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO3S/c1-26-19-10-4-5-11-20(19)27(25)22-17-9-3-2-7-15(17)13-18(21(22)24)16-8-6-12-23-14-16/h2-14,24H,1H3.
What are the key properties of 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol?
1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol has a molecular weight of 375.45 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)sulfinyl-3-pyridin-3-ylnaphthalen-2-ol is sourced from PubChem (CID 118720466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).