RefChem:321242
TL;DR: RefChem:321242 (CAS 83130-94-3) is a chemical compound with molecular formula C24H30N2O3S and molecular weight 426.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2,3-dimethoxy-5-methylsulfanylbenzamide
Also Known As: exo-2,3-Dimethoxy-5-(methylthio)-N-(8-benzyl-8-azabicyclo(3.2.1)oct-3-yl)benzamide, Benzamide, 2,3-dimethoxy-5-(methylthio)-N-(8-(phenylmethyl)-8-azabicyclo(3.2.1)oct-3-yl)-, exo-, N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2,3-dimethoxy-5-methylsulfanylbenzamide, N-(8-Benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2,3-dimethoxy-5-(methylsulfanyl)benzene-1-carboximidic acid, RefChem:321242
| Molecular Formula | C24H30N2O3S |
|---|---|
| Molecular Weight | 426.20 g/mol |
| LogP | 4.3511 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 426.19772 |
| Heavy Atoms | 30 |
| Complexity | 875.51984 |
Chemical Identifiers
| CAS Number | 83130-94-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4)SC |
Product Overview
RefChem:321242 (CAS 83130-94-3), with molecular formula C24H30N2O3S and molecular weight 426.20 g/mol. IUPAC: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2,3-dimethoxy-5-methylsulfanylbenzamide.
Chemical Property Profile of RefChem:321242
Property Insights of RefChem:321242
The XLogP value of 4.3511 indicates that RefChem:321242 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:321242 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:321242 has 1 hydrogen bond donor(s) and 5 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:321242?
The CAS number of RefChem:321242 is 83130-94-3.
What is the molecular formula of RefChem:321242?
The molecular formula of RefChem:321242 is C24H30N2O3S.
What is the molecular weight of RefChem:321242?
The molecular weight of RefChem:321242 is 426.20 g/mol.
Where can I buy RefChem:321242?
You can request a quote for RefChem:321242 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:321242?
Yes, KEHONG BIO provides custom synthesis services for RefChem:321242 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.