AF-399/15335286
TL;DR: AF-399/15335286 (CAS 315685-07-5) is a chemical compound with molecular formula C13H18N2O2S and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(E)-dimethylaminomethylideneamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AF-399/15335286, ethyl 2-{[(dimethylamino)methylene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-{[(dimethylamino)methylidene]amino}-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[(1E)-2-(dimethylamino)-1-azavinyl]-4,5,6-trihydrocyclopenta[2,1-b]thi ophene-3-carboxylate
| Molecular Formula | C13H18N2O2S |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 2.6349 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.1089 |
| Heavy Atoms | 18 |
| Complexity | 477.58096 |
Chemical Identifiers
| CAS Number | 315685-07-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)/N=C/N(C)C |
Product Overview
AF-399/15335286 (CAS 315685-07-5), with molecular formula C13H18N2O2S and molecular weight 266.11 g/mol. IUPAC: ethyl 2-[(E)-dimethylaminomethylideneamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of AF-399/15335286
Property Insights of AF-399/15335286
The XLogP value of 2.6349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/15335286. With a topological polar surface area (TPSA) of 41.9 Ų, AF-399/15335286 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/15335286 has 0 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 AF-399/15335286?
The CAS number of AF-399/15335286 is 315685-07-5.
What is the molecular formula of AF-399/15335286?
The molecular formula of AF-399/15335286 is C13H18N2O2S.
What is the molecular weight of AF-399/15335286?
The molecular weight of AF-399/15335286 is 266.11 g/mol.
Where can I buy AF-399/15335286?
You can request a quote for AF-399/15335286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15335286?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15335286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.