ASN 13408139
TL;DR: ASN 13408139 (CAS 879618-24-3) is a chemical compound with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
Also Known As: ASN 13408139, 2-({5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide, N-(1-adamantyl)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide, N-Adamantan-1-yl-2-(5-p-tolyloxymethyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetamide, 2-[[5-[(4-Methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]-N-tricyclo[3.3.1.13,7]dec-1-ylacetamide
| Molecular Formula | C22H27N3O3S |
|---|---|
| Molecular Weight | 413.18 g/mol |
| LogP | 4.13412 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.1773 |
| Heavy Atoms | 29 |
| Complexity | 844.3984 |
Chemical Identifiers
| CAS Number | 879618-24-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC2=NN=C(O2)SCC(=O)NC34CC5CC(C3)CC(C5)C4 |
Product Overview
ASN 13408139 (CAS 879618-24-3), with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol. IUPAC: N-(1-adamantyl)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of ASN 13408139
Property Insights of ASN 13408139
The XLogP value of 4.13412 indicates that ASN 13408139 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13408139. Following Lipinski's Rule of Five, ASN 13408139 has 1 hydrogen bond donor(s) and 6 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 ASN 13408139?
The CAS number of ASN 13408139 is 879618-24-3.
What is the molecular formula of ASN 13408139?
The molecular formula of ASN 13408139 is C22H27N3O3S.
What is the molecular weight of ASN 13408139?
The molecular weight of ASN 13408139 is 413.18 g/mol.
Where can I buy ASN 13408139?
You can request a quote for ASN 13408139 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13408139?
Yes, KEHONG BIO provides custom synthesis services for ASN 13408139 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.