RefChem:268426
TL;DR: RefChem:268426 (CAS 1676-48-8) is a chemical compound with molecular formula C15H25ClN2O2 and molecular weight 300.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,7-trimethyl-1-(2-morpholin-4-ium-2-ylethyl)-3H-azepin-2-one chloride
Also Known As: 2H-Azepin-2-one, 1,3-dihydro-1-(2-morpholinoethyl)-3,5,7-trimethyl-, hydrochloride, 1-(2-Morpholinoethyl)-1,3-dihydro-3,5,7-trimethyl-2H-azepin-2-one hydrochloride, 3,5,7-trimethyl-1-(2-morpholin-4-ium-2-ylethyl)-3H-azepin-2-one chloride, 2H-Azepin-2-one, 1,3-dihydro-3,5,7-trimethyl-1-[2-(4-morpholinyl)ethyl]-, monohydrochloride, RefChem:268426
| Molecular Formula | C15H25ClN2O2 |
|---|---|
| Molecular Weight | 300.16 g/mol |
| LogP | -2.33 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.16046 |
| Heavy Atoms | 20 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 1676-48-8 |
|---|---|
| SMILES | CC1C=C(C=C(N(C1=O)CCC2C[NH2+]CCO2)C)C.[Cl-] |
| InChIKey | VUJMULXVGSLDBQ-UHFFFAOYSA-N |
Product Overview
RefChem:268426 (CAS 1676-48-8), with molecular formula C15H25ClN2O2 and molecular weight 300.16 g/mol. IUPAC: 3,5,7-trimethyl-1-(2-morpholin-4-ium-2-ylethyl)-3H-azepin-2-one chloride.
Chemical Property Profile of RefChem:268426
Property Insights of RefChem:268426
The XLogP value of -2.33 indicates that RefChem:268426 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.2 Ų, RefChem:268426 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268426 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:268426?
The CAS number of RefChem:268426 is 1676-48-8.
What is the molecular formula of RefChem:268426?
The molecular formula of RefChem:268426 is C15H25ClN2O2.
What is the molecular weight of RefChem:268426?
The molecular weight of RefChem:268426 is 300.16 g/mol.
Where can I buy RefChem:268426?
You can request a quote for RefChem:268426 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268426?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268426 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.