Capsavanil
TL;DR: Capsavanil (CAS 174661-97-3) is a chemical compound with molecular formula C22H31ClN2O3 and molecular weight 406.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-aminoethoxy)-3-methoxyphenyl]-N-[3-(3,4-dimethylphenyl)propyl]acetamide;hydrochloride
Also Known As: Capsavanil, Acetamide deriv, Davasaicin hydrochloride, Da 5018, Benzeneacetamide, 4-(2-aminoethoxy)-N-(3-(3,4-dimethylphenyl)propyl)-3-methoxy-, monohydrochloride
| Molecular Formula | C22H31ClN2O3 |
|---|---|
| Molecular Weight | 406.20 g/mol |
| LogP | 3.36284 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 406.20233 |
| Heavy Atoms | 28 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 174661-97-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)CCCNC(=O)CC2=CC(=C(C=C2)OCCN)OC)C.Cl |
| InChIKey | OUEKLNJUMVZULZ-UHFFFAOYSA-N |
Product Overview
Capsavanil (CAS 174661-97-3), with molecular formula C22H31ClN2O3 and molecular weight 406.20 g/mol. IUPAC: 2-[4-(2-aminoethoxy)-3-methoxyphenyl]-N-[3-(3,4-dimethylphenyl)propyl]acetamide;hydrochloride.
Chemical Property Profile of Capsavanil
Property Insights of Capsavanil
The XLogP value of 3.36284 indicates that Capsavanil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Capsavanil. Following Lipinski's Rule of Five, Capsavanil has 3 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 Capsavanil?
The CAS number of Capsavanil is 174661-97-3.
What is the molecular formula of Capsavanil?
The molecular formula of Capsavanil is C22H31ClN2O3.
What is the molecular weight of Capsavanil?
The molecular weight of Capsavanil is 406.20 g/mol.
Where can I buy Capsavanil?
You can request a quote for Capsavanil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Capsavanil?
Yes, KEHONG BIO provides custom synthesis services for Capsavanil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.