ASN 12722091
TL;DR: ASN 12722091 (CAS 878727-95-8) is a chemical compound with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide
Also Known As: ASN 12722091, VU0508860-1, AB00689128-01, 3,5-dimethyl-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide, F3088-4601
| Molecular Formula | C16H15N3O3S |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 3.28494 |
| Topological Polar Surface Area | 85.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.0834 |
| Heavy Atoms | 23 |
| Complexity | 910.5763 |
Chemical Identifiers
| CAS Number | 878727-95-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=NC(=NS3)CC(=O)C |
Product Overview
ASN 12722091 (CAS 878727-95-8), with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol. IUPAC: 3,5-dimethyl-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of ASN 12722091
Property Insights of ASN 12722091
The XLogP value of 3.28494 indicates that ASN 12722091 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.09 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12722091. Following Lipinski's Rule of Five, ASN 12722091 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 12722091?
The CAS number of ASN 12722091 is 878727-95-8.
What is the molecular formula of ASN 12722091?
The molecular formula of ASN 12722091 is C16H15N3O3S.
What is the molecular weight of ASN 12722091?
The molecular weight of ASN 12722091 is 329.08 g/mol.
Where can I buy ASN 12722091?
You can request a quote for ASN 12722091 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12722091?
Yes, KEHONG BIO provides custom synthesis services for ASN 12722091 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.