RefChem:268423
TL;DR: RefChem:268423 (CAS 1676-25-1) is a chemical compound with molecular formula C15H25ClN2O and molecular weight 284.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,7-trimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)-3H-azepin-2-one chloride
Also Known As: 2H-Azepin-2-one, 1,3-dihydro-1-(2-(1-pyrrolidinyl)ethyl)-3,5,7-trimethyl-, hydrochloride, 1-(2-(1-Pyrrolidinyl)ethyl)-1,3-dihydro-3,5,7-trimethyl-2H-azepin-2-one hydrochloride, 3,5,7-trimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)-3H-azepin-2-one chloride, 2H-Azepin-2-one, 1,3-dihydro-3,5,7-trimethyl-1-[2-(1-pyrrolidinyl)ethyl]-, monohydrochloride, RefChem:268423
| Molecular Formula | C15H25ClN2O |
|---|---|
| Molecular Weight | 284.17 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.16553 |
| Heavy Atoms | 19 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 1676-25-1 |
|---|---|
| SMILES | CC1C=C(C=C(N(C1=O)CC[NH+]2CCCC2)C)C.[Cl-] |
| InChIKey | AOYDZSZBBNGRNX-UHFFFAOYSA-N |
Product Overview
RefChem:268423 (CAS 1676-25-1), with molecular formula C15H25ClN2O and molecular weight 284.17 g/mol. IUPAC: 3,5,7-trimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)-3H-azepin-2-one chloride.
Chemical Property Profile of RefChem:268423
Property Insights of RefChem:268423
The XLogP value of -2.0 indicates that RefChem:268423 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:268423 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268423 has 1 hydrogen bond donor(s) and 2 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:268423?
The CAS number of RefChem:268423 is 1676-25-1.
What is the molecular formula of RefChem:268423?
The molecular formula of RefChem:268423 is C15H25ClN2O.
What is the molecular weight of RefChem:268423?
The molecular weight of RefChem:268423 is 284.17 g/mol.
Where can I buy RefChem:268423?
You can request a quote for RefChem:268423 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268423?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268423 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.