4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine

C24H22N2O3 — CID 175968973

IUPAC4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine
SMILESCOc1ccc(COc2ccc(Cc3ccnc4cnccc34)cc2OC)cc1
InChIInChI=1S/C24H22N2O3/c1-27-20-6-3-17(4-7-20)16-29-23-8-5-18(14-24(23)28-2)13-19-9-12-26-22-15-25-11-10-21(19)22/h3-12,14-15H,13,16H2,1-2H3
InChIKeyVUNMNQXTHGBZLP-UHFFFAOYSA-N
MW386.45 g/mol
LogP4.82
Rot. Bonds7

About 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine

4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine (PubChem CID 175968973) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine.

Molecular Properties

Compound Name4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine
PubChem CID175968973
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine
SMILESCOc1ccc(COc2ccc(Cc3ccnc4cnccc34)cc2OC)cc1
InChIInChI=1S/C24H22N2O3/c1-27-20-6-3-17(4-7-20)16-29-23-8-5-18(14-24(23)28-2)13-19-9-12-26-22-15-25-11-10-21(19)22/h3-12,14-15H,13,16H2,1-2H3
InChIKeyVUNMNQXTHGBZLP-UHFFFAOYSA-N
XLogP4.82
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine?
The IUPAC name of 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine (CID 175968973) is 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine.
What is the SMILES notation for 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine?
The canonical SMILES for 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine is COc1ccc(COc2ccc(Cc3ccnc4cnccc34)cc2OC)cc1.
What is the InChIKey of 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine?
The InChIKey is VUNMNQXTHGBZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-27-20-6-3-17(4-7-20)16-29-23-8-5-18(14-24(23)28-2)13-19-9-12-26-22-15-25-11-10-21(19)22/h3-12,14-15H,13,16H2,1-2H3.
What are the key properties of 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine?
4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine has a molecular weight of 386.45 g/mol, XLogP of 4.82, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-1,7-naphthyridine is sourced from PubChem (CID 175968973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).