RefChem:297118
TL;DR: RefChem:297118 (CAS 57462-66-5) is a chemical compound with molecular formula C16H25ClN2O2 and molecular weight 312.16046 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl)ethyl-diethylazanium chloride
Also Known As: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-4-(2-diethylaminoethyl)-2,6-dimethyl-, hydrochloride, 4H-1,4-Benzoxazin-3-one, 4-(2-diethylaminoethyl)-2,3-dihydro-2,6-dimethyl-, hydrochloride, 2-(2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl)ethyl-diethylazanium chloride, 2H-1,4-Benzoxazin-3(4H)-one, 4-[2-(diethylamino)ethyl]-2,6-dimethyl-, monohydrochloride
Technical Specifications
| Molecular Formula | C16H25ClN2O2 |
| Molecular Weight | 312.16046 g/mol |
| XLogP | -1.96 |
| Topological Polar Surface Area (TPSA) | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.16046 Da |
| Heavy Atoms | 21 |
| Complexity | 330.0 |
| SMILES | CC[NH+](CC)CCN1C2=C(C=CC(=C2)C)OC(C1=O)C.[Cl-] |
| InChIKey | NAMSOPNNAZYEMZ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:297118
Property Insights of RefChem:297118
The XLogP value of -1.96 indicates that RefChem:297118 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.0 Ų, RefChem:297118 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:297118 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:297118?
The CAS number of RefChem:297118 is 57462-66-5.
What is the molecular formula of RefChem:297118?
The molecular formula of RefChem:297118 is C16H25ClN2O2.
What is the molecular weight of RefChem:297118?
The molecular weight of RefChem:297118 is 312.16046 g/mol.
Where can I buy RefChem:297118?
You can request a quote for RefChem:297118 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:297118?
Yes, CoreyChem provides custom synthesis services for RefChem:297118 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.