1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride
TL;DR: 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride (CAS 2906-75-4) is a chemical compound with molecular formula C16H24ClNO3 and molecular weight 313.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride
Also Known As: P-14, 1-(2-(1,4-Benzodioxan-5-yloxy)ethyl)hexahydro-1H-azepine hydrochloride, 1H-AZEPINE, HEXAHYDRO-1-(2-(1,4-BENZODIOXAN-5-YLOXY)ETHYL)-, HYDROCHLORIDE, 1-[2-(2,3-Dihydro-1,4-benzodioxin-8-yloxy)ethyl]azepan-1-ium chloride, 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride
| Molecular Formula | C16H24ClNO3 |
|---|---|
| Molecular Weight | 313.14 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.14447 |
| Heavy Atoms | 21 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 2906-75-4 |
|---|---|
| SMILES | C1CCC[NH+](CC1)CCOC2=CC=CC3=C2OCCO3.[Cl-] |
| InChIKey | QJEULQBVWVENJZ-UHFFFAOYSA-N |
Product Overview
1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride (CAS 2906-75-4), with molecular formula C16H24ClNO3 and molecular weight 313.14 g/mol. IUPAC: 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride.
Chemical Property Profile of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride
Property Insights of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride
The XLogP value of -1.7 indicates that 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.1 Ų, 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 4 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 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride?
The CAS number of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride is 2906-75-4.
What is the molecular formula of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride?
The molecular formula of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride is C16H24ClNO3.
What is the molecular weight of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride?
The molecular weight of 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride is 313.14 g/mol.
Where can I buy 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride?
You can request a quote for 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Azepine, hexahydro-1-(2-(1,4-benzodioxan-5-yloxy)ethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.