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

C23H21N3O3 — CID 2817565

IUPAC6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCCc1c(C)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c2n(C)c1=O
InChIInChI=1S/C23H21N3O3/c1-4-18-15(2)19-20(24(3)21(18)27)25(16-11-7-5-8-12-16)23(29)26(22(19)28)17-13-9-6-10-14-17/h5-14H,4H2,1-3H3
InChIKeyJCIGDEGHLPQBJC-UHFFFAOYSA-N
MW387.44 g/mol
LogP2.71
Rot. Bonds3

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

6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione (PubChem CID 2817565) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione.

Molecular Properties

Compound Name6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
PubChem CID2817565
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC Name6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCCc1c(C)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c2n(C)c1=O
InChIInChI=1S/C23H21N3O3/c1-4-18-15(2)19-20(24(3)21(18)27)25(16-11-7-5-8-12-16)23(29)26(22(19)28)17-13-9-6-10-14-17/h5-14H,4H2,1-3H3
InChIKeyJCIGDEGHLPQBJC-UHFFFAOYSA-N
XLogP2.71
TPSA66.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-ethyl-5,8-dimethyl-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

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The IUPAC name of 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione (CID 2817565) is 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione.
What is the SMILES notation for 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The canonical SMILES for 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione is CCc1c(C)c2c(=O)n(-c3ccccc3)c(=O)n(-c3ccccc3)c2n(C)c1=O.
What is the InChIKey of 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
The InChIKey is JCIGDEGHLPQBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-4-18-15(2)19-20(24(3)21(18)27)25(16-11-7-5-8-12-16)23(29)26(22(19)28)17-13-9-6-10-14-17/h5-14H,4H2,1-3H3.
What are the key properties of 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione?
6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione has a molecular weight of 387.44 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione is sourced from PubChem (CID 2817565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).