RefChem:297116
TL;DR: RefChem:297116 (CAS 57462-85-8) is a chemical compound with molecular formula C15H23ClN2O2 and molecular weight 298.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazanium chloride
Also Known As: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-2,6-dimethyl-4-(2-(dimethylamino)propyl)-, hydrochloride, 1-(2,6-Dimethyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazaniumchloride, 1-(2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazanium chloride, 2H-1,4-Benzoxazin-3(4H)-one, 4-[2-(dimethylamino)propyl]-2,6-dimethyl-, monohydrochloride, 4H-1,4-BENZOXAZIN-3-ONE, 2,3-DIHYDRO-2,6-DIMETHYL-4-(2-(DIMETHYLAMINO)PROPYL)-,
| Molecular Formula | C15H23ClN2O2 |
|---|---|
| Molecular Weight | 298.14 g/mol |
| LogP | -2.35 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.1448 |
| Heavy Atoms | 20 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 57462-85-8 |
|---|---|
| SMILES | CC1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(C)[NH+](C)C.[Cl-] |
| InChIKey | GJDMTPFVCPFMQA-UHFFFAOYSA-N |
Product Overview
RefChem:297116 (CAS 57462-85-8), with molecular formula C15H23ClN2O2 and molecular weight 298.14 g/mol. IUPAC: 1-(2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazanium chloride.
Chemical Property Profile of RefChem:297116
Property Insights of RefChem:297116
The XLogP value of -2.35 indicates that RefChem:297116 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:297116 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:297116 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
Frequently Asked Questions
What is the CAS number of RefChem:297116?
The CAS number of RefChem:297116 is 57462-85-8.
What is the molecular formula of RefChem:297116?
The molecular formula of RefChem:297116 is C15H23ClN2O2.
What is the molecular weight of RefChem:297116?
The molecular weight of RefChem:297116 is 298.14 g/mol.
Where can I buy RefChem:297116?
You can request a quote for RefChem:297116 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:297116?
Yes, KEHONG BIO provides custom synthesis services for RefChem:297116 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.