RefChem:321403
TL;DR: RefChem:321403 (CAS 83130-79-4) is a chemical compound with molecular formula C25H33ClN2O3 and molecular weight 444.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-ethoxy-3-methoxybenzamide;hydrochloride
Also Known As: exo-2-Ethoxy-3-methoxy-N-(9-benzyl-9-azabicyclo(3.2.1)non-3-yl)benzamide hydrochloride, Benzamide, 2-ethoxy-3-methoxy-N-(9-(phenylmethyl)-9-azabicyclo(3.3.1)non-3-yl)-, monohydrochloride, exo-, N-(9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-ethoxy-3-methoxybenzamide hydrochloride, N-(9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-ethoxy-3-methoxybenzamide,hydrochloride, N-(9-Benzyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-ethoxy-3-methoxybenzene-1-carboximidic acid--hydrogen chloride (1/1)
| Molecular Formula | C25H33ClN2O3 |
|---|---|
| Molecular Weight | 444.22 g/mol |
| LogP | 4.8312 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.21796 |
| Heavy Atoms | 31 |
| Complexity | 847.1005 |
Chemical Identifiers
| CAS Number | 83130-79-4 |
|---|---|
| SMILES | CCOC1=C(C=CC=C1OC)C(=O)NC2CC3CCCC(C2)N3CC4=CC=CC=C4.Cl |
Product Overview
RefChem:321403 (CAS 83130-79-4), with molecular formula C25H33ClN2O3 and molecular weight 444.22 g/mol. IUPAC: N-(9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-ethoxy-3-methoxybenzamide;hydrochloride.
Chemical Property Profile of RefChem:321403
Property Insights of RefChem:321403
The XLogP value of 4.8312 indicates that RefChem:321403 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, RefChem:321403 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:321403 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 RefChem:321403?
The CAS number of RefChem:321403 is 83130-79-4.
What is the molecular formula of RefChem:321403?
The molecular formula of RefChem:321403 is C25H33ClN2O3.
What is the molecular weight of RefChem:321403?
The molecular weight of RefChem:321403 is 444.22 g/mol.
Where can I buy RefChem:321403?
You can request a quote for RefChem:321403 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:321403?
Yes, KEHONG BIO provides custom synthesis services for RefChem:321403 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.