2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one

C20H16N4O3 — CID 3234042

IUPAC2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one
SMILESCOc1ccc(-c2nc3cnc(OC)nc3n(-c3ccccc3)c2=O)cc1
InChIInChI=1S/C20H16N4O3/c1-26-15-10-8-13(9-11-15)17-19(25)24(14-6-4-3-5-7-14)18-16(22-17)12-21-20(23-18)27-2/h3-12H,1-2H3
InChIKeyPXFMFKPONFFSMS-UHFFFAOYSA-N
MW360.37 g/mol
LogP2.86
Rot. Bonds4

About 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one

2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one (PubChem CID 3234042) has the molecular formula C20H16N4O3 and a molecular weight of 360.37 g/mol. Its IUPAC name is 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one.

Molecular Properties

Compound Name2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one
PubChem CID3234042
Molecular FormulaC20H16N4O3
Molecular Weight360.37 g/mol
Exact Mass360.12
IUPAC Name2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one
SMILESCOc1ccc(-c2nc3cnc(OC)nc3n(-c3ccccc3)c2=O)cc1
InChIInChI=1S/C20H16N4O3/c1-26-15-10-8-13(9-11-15)17-19(25)24(14-6-4-3-5-7-14)18-16(22-17)12-21-20(23-18)27-2/h3-12H,1-2H3
InChIKeyPXFMFKPONFFSMS-UHFFFAOYSA-N
XLogP2.86
TPSA79.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

6-(4-chlorophenyl)-2-(4-methoxyphenoxy)-8-methylpteridin-7-one
CID 3235196
6-(3,4-difluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one
CID 3234422
2-anilino-8-(2-methoxyethyl)-6-(4-methoxyphenyl)pteridin-7-one
CID 3234766
6-(4-chlorophenyl)-2-methoxy-8-(thiophen-2-ylmethyl)pteridin-7-one
CID 3233317
2-(3-chlorophenoxy)-8-(2-methoxyethyl)-6-(4-methoxyphenyl)pteridin-7-one
CID 3234895
3,6-bis[3-(4-methoxyphenyl)quinoxalin-2-yl]-9-phenylcarbazole
CID 101405033
2-(dimethylamino)-8-(4-methoxyphenyl)-6-methylpteridin-7-one
CID 3233681
8-[4-(difluoromethoxy)phenyl]-2-ethoxy-6-[2-(methoxymethyl)-3-methylbenzimidazol-5-yl]pteridin-7-one
CID 167273113
2-(3-methoxyanilino)-8-methyl-6-phenylpteridin-7-one
CID 3233469
2-methoxy-8-methyl-6-(1-methylindol-3-yl)pteridin-7-one
CID 3233427
5-(4-methoxyphenyl)-6-(4-methylphenyl)-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 2275304
8-(4-methoxyphenyl)-2-morpholin-4-yl-6-thiophen-2-ylpteridin-7-one
CID 3233814

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one?
The IUPAC name of 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one (CID 3234042) is 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one.
What is the SMILES notation for 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one?
The canonical SMILES for 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one is COc1ccc(-c2nc3cnc(OC)nc3n(-c3ccccc3)c2=O)cc1.
What is the InChIKey of 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one?
The InChIKey is PXFMFKPONFFSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O3/c1-26-15-10-8-13(9-11-15)17-19(25)24(14-6-4-3-5-7-14)18-16(22-17)12-21-20(23-18)27-2/h3-12H,1-2H3.
What are the key properties of 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one?
2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one has a molecular weight of 360.37 g/mol, XLogP of 2.86, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(4-methoxyphenyl)-8-phenylpteridin-7-one is sourced from PubChem (CID 3234042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).