6-m-Tolylamino-1H-pyrimidine-2,4-dione
TL;DR: 6-m-Tolylamino-1H-pyrimidine-2,4-dione (CAS 21332-93-4) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-methylanilino)-1H-pyrimidine-2,4-dione
Also Known As: 6-m-Tolylamino-1H-pyrimidine-2,4-dione, BAS 00471542, 6-(3-methylanilino)-1H-pyrimidine-2,4-dione, BIM-0020770.P001, 6-(3-Methylanilino)pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C11H11N3O2 |
|---|---|
| Molecular Weight | 217.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.08513 |
| Heavy Atoms | 16 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 21332-93-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=CC(=O)NC(=O)N2 |
| InChIKey | STFBFOVWNBTISN-UHFFFAOYSA-N |
Product Overview
6-m-Tolylamino-1H-pyrimidine-2,4-dione (CAS 21332-93-4), with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol. IUPAC: 6-(3-methylanilino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-m-Tolylamino-1H-pyrimidine-2,4-dione
Property Insights of 6-m-Tolylamino-1H-pyrimidine-2,4-dione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-m-Tolylamino-1H-pyrimidine-2,4-dione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-m-Tolylamino-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-m-Tolylamino-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-m-Tolylamino-1H-pyrimidine-2,4-dione?
The CAS number of 6-m-Tolylamino-1H-pyrimidine-2,4-dione is 21332-93-4.
What is the molecular formula of 6-m-Tolylamino-1H-pyrimidine-2,4-dione?
The molecular formula of 6-m-Tolylamino-1H-pyrimidine-2,4-dione is C11H11N3O2.
What is the molecular weight of 6-m-Tolylamino-1H-pyrimidine-2,4-dione?
The molecular weight of 6-m-Tolylamino-1H-pyrimidine-2,4-dione is 217.09 g/mol.
Where can I buy 6-m-Tolylamino-1H-pyrimidine-2,4-dione?
You can request a quote for 6-m-Tolylamino-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-m-Tolylamino-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-m-Tolylamino-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.