4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide

C24H23N3O5S — CID 170336010

IUPAC4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide
SMILESCOc1ccc(C(C)NS(=O)(=O)c2ccc(Oc3ccnc4c(OC)nccc34)cc2)cc1
InChIInChI=1S/C24H23N3O5S/c1-16(17-4-6-18(30-2)7-5-17)27-33(28,29)20-10-8-19(9-11-20)32-22-13-15-25-23-21(22)12-14-26-24(23)31-3/h4-16,27H,1-3H3
InChIKeyXUVHLOGJXZQJGS-UHFFFAOYSA-N
MW465.53 g/mol
LogP4.48
Rot. Bonds8

About 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide

4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide (PubChem CID 170336010) has the molecular formula C24H23N3O5S and a molecular weight of 465.53 g/mol. Its IUPAC name is 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide
PubChem CID170336010
Molecular FormulaC24H23N3O5S
Molecular Weight465.53 g/mol
Exact Mass465.14
IUPAC Name4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide
SMILESCOc1ccc(C(C)NS(=O)(=O)c2ccc(Oc3ccnc4c(OC)nccc34)cc2)cc1
InChIInChI=1S/C24H23N3O5S/c1-16(17-4-6-18(30-2)7-5-17)27-33(28,29)20-10-8-19(9-11-20)32-22-13-15-25-23-21(22)12-14-26-24(23)31-3/h4-16,27H,1-3H3
InChIKeyXUVHLOGJXZQJGS-UHFFFAOYSA-N
XLogP4.48
TPSA99.64 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.53
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide with MolForge

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Related Compounds

N-[4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]phenyl]sulfanyl-1-(4-methoxyphenyl)ethanamine
CID 170592723
N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-propan-2-ylbenzenesulfonamide
CID 74226638
N-[1-(4-ethoxyphenyl)ethyl]-4-methoxybenzenesulfonamide
CID 22204767
4-methoxy-N-(1-phenylethyl)benzenesulfonamide
CID 4092765
4-butan-2-yl-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 22201321
N-[(1S)-1-(4-ethylphenyl)ethyl]-4-methoxybenzenesulfonamide
CID 27511343
2,4-dimethoxy-N-[(1S)-1-pyridin-4-ylethyl]benzenesulfonamide
CID 40790424
N-[(1S)-1-(4-methoxyphenyl)ethyl]methanesulfonamide
CID 81363887
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 28552297
N-[1,2-bis(4-methoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]ethyl]-4-methylbenzenesulfonamide
CID 101196699
4-methoxy-N-[(1R,2S)-2-[(4-methoxyphenyl)sulfonylamino]-1,2-dinaphthalen-2-ylethyl]benzenesulfonamide
CID 2794488
2,5-dimethoxy-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 3852201

Frequently Asked Questions

What is the IUPAC name of 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide?
The IUPAC name of 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide (CID 170336010) is 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide is COc1ccc(C(C)NS(=O)(=O)c2ccc(Oc3ccnc4c(OC)nccc34)cc2)cc1.
What is the InChIKey of 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide?
The InChIKey is XUVHLOGJXZQJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O5S/c1-16(17-4-6-18(30-2)7-5-17)27-33(28,29)20-10-8-19(9-11-20)32-22-13-15-25-23-21(22)12-14-26-24(23)31-3/h4-16,27H,1-3H3.
What are the key properties of 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide?
4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide has a molecular weight of 465.53 g/mol, XLogP of 4.48, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(8-methoxy-1,7-naphthyridin-4-yl)oxy]-N-[1-(4-methoxyphenyl)ethyl]benzenesulfonamide is sourced from PubChem (CID 170336010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).