N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide
TL;DR: N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide (CAS 831207-32-0) is a chemical compound with molecular formula C13H13N3O3 and molecular weight 259.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide
Also Known As: CK2-IN-10, N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide, N-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-3,4-dimethylbenzamide
| Molecular Formula | C13H13N3O3 |
|---|---|
| Molecular Weight | 259.10 g/mol |
| LogP | 0.93234 |
| Topological Polar Surface Area | 94.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.0957 |
| Heavy Atoms | 19 |
| Complexity | 743.28406 |
Chemical Identifiers
| CAS Number | 831207-32-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=CNC(=O)NC2=O)C |
Product Overview
N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide (CAS 831207-32-0), with molecular formula C13H13N3O3 and molecular weight 259.10 g/mol. IUPAC: N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide.
Chemical Property Profile of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide
Property Insights of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide
The XLogP value of 0.93234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide. The TPSA of 94.82 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide. Following Lipinski's Rule of Five, N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide?
The CAS number of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide is 831207-32-0.
What is the molecular formula of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide?
The molecular formula of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide is C13H13N3O3.
What is the molecular weight of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide?
The molecular weight of N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide is 259.10 g/mol.
Where can I buy N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide?
You can request a quote for N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.