5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione

C20H15N3O4 — CID 54705836

IUPAC5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCn1c(=O)cc(O)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c21
InChIInChI=1S/C20H15N3O4/c1-21-16(25)12-15(24)17-18(21)22(13-8-4-2-5-9-13)20(27)23(19(17)26)14-10-6-3-7-11-14/h2-12,24H,1H3
InChIKeyBDRCKAGCCDRJDZ-UHFFFAOYSA-N
MW361.36 g/mol
LogP1.55
Rot. Bonds2

About 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione

5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione (PubChem CID 54705836) has the molecular formula C20H15N3O4 and a molecular weight of 361.36 g/mol. Its IUPAC name is 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione.

Molecular Properties

Compound Name5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
PubChem CID54705836
Molecular FormulaC20H15N3O4
Molecular Weight361.36 g/mol
Exact Mass361.11
IUPAC Name5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCn1c(=O)cc(O)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c21
InChIInChI=1S/C20H15N3O4/c1-21-16(25)12-15(24)17-18(21)22(13-8-4-2-5-9-13)20(27)23(19(17)26)14-10-6-3-7-11-14/h2-12,24H,1H3
InChIKeyBDRCKAGCCDRJDZ-UHFFFAOYSA-N
XLogP1.55
TPSA86.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-hydroxy-1-phenylpyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione
CID 54683793
5-hydroxy-3-methyl-1-phenylpyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione
CID 54677776
5-hydroxy-1,3-dimethyl-8-phenylpyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione
CID 54687615
(Z)-4-[1,3-bis(2-fluorophenyl)-2,4-dioxo-pyrimidin-5-yl]-2-hydroxy-4-oxo-but-2-enoic acid
CID 134815662
(Z)-4-[1,3-bis(4-fluorophenyl)-2,4-dioxo-pyrimidin-5-yl]-2-hydroxy-4-oxo-but-2-enoic acid
CID 134815663
(Z)-4-[3-(4-fluorophenyl)-2,4-dioxo-1-phenyl-pyrimidin-5-yl]-2-hydroxy-4-oxo-but-2-enoic acid
CID 134815727
3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-5-hydroxy-6,8-dimethylpyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione
CID 59717004
6-Ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 2817565
5-Hydroxy-8-methyl-6-nitro-1,3-diphenyl-pyrido[2,3-d]-pyrimidine-2,4,7(1h,3h,8h)-trione
CID 54687617
6-(Benzyliminomethyl)-5-hydroxy-1,3-dimethyl-8-phenylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 135454270
1-(2-fluoro-4-iodophenyl)-5-hydroxy-3,6,8-trimethyl-1H,8H-pyrido[2,3-d]pyrimidine-2,4,7-trione
CID 59717046
3-(2-Fluoro-4-iodophenyl)-5-hydroxy-1,6,8-trimethylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 59717136

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The IUPAC name of 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione (CID 54705836) is 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione.
What is the SMILES notation for 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The canonical SMILES for 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione is Cn1c(=O)cc(O)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c21.
What is the InChIKey of 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The InChIKey is BDRCKAGCCDRJDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O4/c1-21-16(25)12-15(24)17-18(21)22(13-8-4-2-5-9-13)20(27)23(19(17)26)14-10-6-3-7-11-14/h2-12,24H,1H3.
What are the key properties of 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione has a molecular weight of 361.36 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione is sourced from PubChem (CID 54705836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).