RefChem:297129
TL;DR: RefChem:297129 (CAS 57462-80-3) is a chemical compound with molecular formula C14H20Cl2N2O2 and molecular weight 318.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazanium chloride
Also Known As: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-6-chloro-4-(2-(dimethylamino)propyl)-2-methyl-, hydrochloride, 1-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazanium chloride, 4H-1,4-BENZOXAZIN-3-ONE, 2,3-DIHYDRO-6-CHLORO-4-(2-(DIMETHYLAMINO)PROPYL)-2-METH, 2H-1,4-Benzoxazin-3(4H)-one, 6-chloro-4-[2-(dimethylamino)propyl]-2-methyl-, monohydrochloride, RefChem:297129
| Molecular Formula | C14H20Cl2N2O2 |
|---|---|
| Molecular Weight | 318.09 g/mol |
| LogP | -2.01 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.09018 |
| Heavy Atoms | 20 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 57462-80-3 |
|---|---|
| SMILES | CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CC(C)[NH+](C)C.[Cl-] |
| InChIKey | UPAMVMOKVCRLFY-UHFFFAOYSA-N |
Product Overview
RefChem:297129 (CAS 57462-80-3), with molecular formula C14H20Cl2N2O2 and molecular weight 318.09 g/mol. IUPAC: 1-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propan-2-yl-dimethylazanium chloride.
Chemical Property Profile of RefChem:297129
Property Insights of RefChem:297129
The XLogP value of -2.01 indicates that RefChem:297129 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:297129 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:297129 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:297129?
The CAS number of RefChem:297129 is 57462-80-3.
What is the molecular formula of RefChem:297129?
The molecular formula of RefChem:297129 is C14H20Cl2N2O2.
What is the molecular weight of RefChem:297129?
The molecular weight of RefChem:297129 is 318.09 g/mol.
Where can I buy RefChem:297129?
You can request a quote for RefChem:297129 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:297129?
Yes, KEHONG BIO provides custom synthesis services for RefChem:297129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.