![6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione structure](/static/products/2133/21333-16-4.webp)
6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione
TL;DR: 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione (CAS 21333-16-4) is a chemical compound with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione
Also Known As: 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione, 6-{[(2,5-Dimethylphenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C13H15N3O2 |
|---|---|
| Molecular Weight | 245.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.11642 |
| Heavy Atoms | 18 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 21333-16-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)CNC2=CC(=O)NC(=O)N2 |
| InChIKey | NBRFUDGEDZDKFG-UHFFFAOYSA-N |
Product Overview
6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione (CAS 21333-16-4), with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol. IUPAC: 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione
Property Insights of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione 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 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione?
The CAS number of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione is 21333-16-4.
What is the molecular formula of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione?
The molecular formula of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione is C13H15N3O2.
What is the molecular weight of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione?
The molecular weight of 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione is 245.12 g/mol.
Where can I buy 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione?
You can request a quote for 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[(2,5-dimethylphenyl)methylamino]-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.