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

C22H19N3O4 — CID 54705837

IUPAC6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCCc1c(O)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c2n(C)c1=O
InChIInChI=1S/C22H19N3O4/c1-3-16-18(26)17-19(23(2)20(16)27)24(14-10-6-4-7-11-14)22(29)25(21(17)28)15-12-8-5-9-13-15/h4-13,26H,3H2,1-2H3
InChIKeyPWIXLVOXDKFWSO-UHFFFAOYSA-N
MW389.41 g/mol
LogP2.11
Rot. Bonds3

About 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione

6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione (PubChem CID 54705837) has the molecular formula C22H19N3O4 and a molecular weight of 389.41 g/mol. Its IUPAC name is 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione.

Molecular Properties

Compound Name6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
PubChem CID54705837
Molecular FormulaC22H19N3O4
Molecular Weight389.41 g/mol
Exact Mass389.14
IUPAC Name6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCCc1c(O)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c2n(C)c1=O
InChIInChI=1S/C22H19N3O4/c1-3-16-18(26)17-19(23(2)20(16)27)24(14-10-6-4-7-11-14)22(29)25(21(17)28)15-12-8-5-9-13-15/h4-13,26H,3H2,1-2H3
InChIKeyPWIXLVOXDKFWSO-UHFFFAOYSA-N
XLogP2.11
TPSA86.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.41
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione 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

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 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The IUPAC name of 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione (CID 54705837) is 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione.
What is the SMILES notation for 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The canonical SMILES for 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione is CCc1c(O)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c2n(C)c1=O.
What is the InChIKey of 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The InChIKey is PWIXLVOXDKFWSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O4/c1-3-16-18(26)17-19(23(2)20(16)27)24(14-10-6-4-7-11-14)22(29)25(21(17)28)15-12-8-5-9-13-15/h4-13,26H,3H2,1-2H3.
What are the key properties of 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione has a molecular weight of 389.41 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione is sourced from PubChem (CID 54705837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).