3-(2,6-Xylyl)-5-methylhydantoin
TL;DR: 3-(2,6-Xylyl)-5-methylhydantoin (CAS 72998-95-9) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,6-dimethylphenyl)-5-methylimidazolidine-2,4-dione
Also Known As: 3-(2,6-Xylyl)-5-methylhydantoin, 3-(2,6-dimethylphenyl)-5-methylimidazolidine-2,4-dione, 2,4-Imidazolidinedione, 3-(2,6-dimethylphenyl)-5-methyl-, 2,4-Imidazolidinedione,3-(2,6-dimethylphenyl)-5-methyl-, 1-(2,6-Dimethylphenyl)-4-methyl-1H-imidazole-2,5(3H,4H)-dione
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 1.74814 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 447.8366 |
Chemical Identifiers
| CAS Number | 72998-95-9 |
|---|---|
| SMILES | CC1C(=O)N(C(=O)N1)C2=C(C=CC=C2C)C |
Product Overview
3-(2,6-Xylyl)-5-methylhydantoin (CAS 72998-95-9), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 3-(2,6-dimethylphenyl)-5-methylimidazolidine-2,4-dione.
Chemical Property Profile of 3-(2,6-Xylyl)-5-methylhydantoin
Property Insights of 3-(2,6-Xylyl)-5-methylhydantoin
The XLogP value of 1.74814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,6-Xylyl)-5-methylhydantoin. With a topological polar surface area (TPSA) of 49.41 Ų, 3-(2,6-Xylyl)-5-methylhydantoin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,6-Xylyl)-5-methylhydantoin has 1 hydrogen bond donor(s) and 2 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 3-(2,6-Xylyl)-5-methylhydantoin?
The CAS number of 3-(2,6-Xylyl)-5-methylhydantoin is 72998-95-9.
What is the molecular formula of 3-(2,6-Xylyl)-5-methylhydantoin?
The molecular formula of 3-(2,6-Xylyl)-5-methylhydantoin is C12H14N2O2.
What is the molecular weight of 3-(2,6-Xylyl)-5-methylhydantoin?
The molecular weight of 3-(2,6-Xylyl)-5-methylhydantoin is 218.11 g/mol.
Where can I buy 3-(2,6-Xylyl)-5-methylhydantoin?
You can request a quote for 3-(2,6-Xylyl)-5-methylhydantoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,6-Xylyl)-5-methylhydantoin?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,6-Xylyl)-5-methylhydantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.