6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one

C19H13FN4O2 — CID 3232991

IUPAC6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one
SMILESCOc1ccc(-n2c(=O)c(-c3cccc(F)c3)nc3cncnc32)cc1
InChIInChI=1S/C19H13FN4O2/c1-26-15-7-5-14(6-8-15)24-18-16(10-21-11-22-18)23-17(19(24)25)12-3-2-4-13(20)9-12/h2-11H,1H3
InChIKeySJICLTOLSUZNEJ-UHFFFAOYSA-N
MW348.34 g/mol
LogP2.99
Rot. Bonds3

About 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one

6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one (PubChem CID 3232991) has the molecular formula C19H13FN4O2 and a molecular weight of 348.34 g/mol. Its IUPAC name is 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one.

Molecular Properties

Compound Name6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one
PubChem CID3232991
Molecular FormulaC19H13FN4O2
Molecular Weight348.34 g/mol
Exact Mass348.10
IUPAC Name6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one
SMILESCOc1ccc(-n2c(=O)c(-c3cccc(F)c3)nc3cncnc32)cc1
InChIInChI=1S/C19H13FN4O2/c1-26-15-7-5-14(6-8-15)24-18-16(10-21-11-22-18)23-17(19(24)25)12-3-2-4-13(20)9-12/h2-11H,1H3
InChIKeySJICLTOLSUZNEJ-UHFFFAOYSA-N
XLogP2.99
TPSA69.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.34
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Mppf F-18
CID 449646
4-Fluoro-N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-N-2-pyridinylbenzamide
CID 6603915
p-(18F)MPPF
CID 5352127
6-(2,6-Dichlorophenyl)-2-(4-methoxyphenylamino)-8-methyl-8H-pyrido[2,3-d]pyrimidin-7-one
CID 5327896
Pyrido[2,3-d]pyrimidin-7-one deriv. 28
CID 5328641
2-(4-(2-diethylaminoethoxy)phenylamino)-8-ethyl-6-phenyl-8H-pyrido(2,3-d)pyrimidin-7-one
CID 5328650
Benzo[e]pyrimido[5,4-b][1,4]diazepin-6(11H)-one, 10
CID 57340657
N-[3-[6-(2-fluorophenyl)-2-[4-(2-methoxyethoxy)anilino]-7-oxopteridin-8-yl]phenyl]prop-2-enamide
CID 166625820
2,4-Bisanilinopyrimidine, 42
CID 44224097
4-(4-Fluorophenyl)-1,2-dimethyl-5-(2-phenoxypyrimidin-4-yl)-1,2-dihydropyrazol-3-one
CID 10150429
N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenylimidazol-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(pyridin-3-ylmethyl)acetamide
CID 11498089
N-[2-[6-(benzylamino)-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CID 24830706

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one?
The IUPAC name of 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one (CID 3232991) is 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one.
What is the SMILES notation for 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one?
The canonical SMILES for 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one is COc1ccc(-n2c(=O)c(-c3cccc(F)c3)nc3cncnc32)cc1.
What is the InChIKey of 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one?
The InChIKey is SJICLTOLSUZNEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4O2/c1-26-15-7-5-14(6-8-15)24-18-16(10-21-11-22-18)23-17(19(24)25)12-3-2-4-13(20)9-12/h2-11H,1H3.
What are the key properties of 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one?
6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one has a molecular weight of 348.34 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one is sourced from PubChem (CID 3232991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).