RefChem:297135
TL;DR: RefChem:297135 (CAS 57462-78-9) is a chemical compound with molecular formula C16H24Cl2N2O2 and molecular weight 346.1215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-diethylazanium chloride
Also Known As: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-6-chloro-4-(3-diethylaminopropyl)-2-methyl-, hydrochloride, 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-diethylazanium chloride, 4H-1,4-BENZOXAZIN-3-ONE, 2,3-DIHYDRO-6-CHLORO-4-(3-DIETHYLAMINOPROPYL)-2-METHYL-, 2H-1,4-Benzoxazin-3(4H)-one, 6-chloro-4-[3-(diethylamino)propyl]-2-methyl-, monohydrochloride
Technical Specifications
| Molecular Formula | C16H24Cl2N2O2 |
| Molecular Weight | 346.1215 g/mol |
| XLogP | -1.23 |
| Topological Polar Surface Area (TPSA) | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.1215 Da |
| Heavy Atoms | 22 |
| Complexity | 349.0 |
| SMILES | CC[NH+](CC)CCCN1C2=C(C=CC(=C2)Cl)OC(C1=O)C.[Cl-] |
| InChIKey | JWRZCPAJSVTHSO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:297135
Property Insights of RefChem:297135
The XLogP value of -1.23 indicates that RefChem:297135 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:297135 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:297135 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:297135?
The CAS number of RefChem:297135 is 57462-78-9.
What is the molecular formula of RefChem:297135?
The molecular formula of RefChem:297135 is C16H24Cl2N2O2.
What is the molecular weight of RefChem:297135?
The molecular weight of RefChem:297135 is 346.1215 g/mol.
Where can I buy RefChem:297135?
You can request a quote for RefChem:297135 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:297135?
Yes, CoreyChem provides custom synthesis services for RefChem:297135 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.