AF-399/13428275
TL;DR: AF-399/13428275 (CAS 302803-20-9) is a chemical compound with molecular formula C18H19NO5S and molecular weight 361.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-methoxyphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AF-399/13428275, methyl 2-{[(4-methoxyphenoxy)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-[[2-(4-methoxyphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-(2-(4-methoxyphenoxy)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-[2-(4-methoxyphenoxy)acetylamino]-4,5,6-trihydrocyclopenta[2,1-b]thio phene-3-carboxylate
| Molecular Formula | C18H19NO5S |
|---|---|
| Molecular Weight | 361.10 g/mol |
| LogP | 3.0495 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.0984 |
| Heavy Atoms | 25 |
| Complexity | 781.5093 |
Chemical Identifiers
| CAS Number | 302803-20-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC |
Product Overview
AF-399/13428275 (CAS 302803-20-9), with molecular formula C18H19NO5S and molecular weight 361.10 g/mol. IUPAC: methyl 2-[[2-(4-methoxyphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of AF-399/13428275
Property Insights of AF-399/13428275
The XLogP value of 3.0495 indicates that AF-399/13428275 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/13428275. Following Lipinski's Rule of Five, AF-399/13428275 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 AF-399/13428275?
The CAS number of AF-399/13428275 is 302803-20-9.
What is the molecular formula of AF-399/13428275?
The molecular formula of AF-399/13428275 is C18H19NO5S.
What is the molecular weight of AF-399/13428275?
The molecular weight of AF-399/13428275 is 361.10 g/mol.
Where can I buy AF-399/13428275?
You can request a quote for AF-399/13428275 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/13428275?
Yes, KEHONG BIO provides custom synthesis services for AF-399/13428275 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.