AF-399/41075286
TL;DR: AF-399/41075286 (CAS 443644-29-9) is a chemical compound with molecular formula C14H11N3O2S and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-7-methyl-5-oxo-4-thiophen-2-yl-4,6-dihydropyrano[3,2-c]pyridine-3-carbonitrile
Also Known As: AF-399/41075286, 2-amino-7-methyl-5-oxo-4-(thiophen-2-yl)-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, 2-amino-7-methyl-5-oxo-4-(2-thienyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, 2-amino-5-hydroxy-7-methyl-4-(thiophen-2-yl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile, 2-amino-7-methyl-5-oxo-4-(2-thienyl)-6-hydro-4H-pyrano[3,2-c]pyridine-3-carbon itrile
| Molecular Formula | C14H11N3O2S |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 1.963 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.0572 |
| Heavy Atoms | 20 |
| Complexity | 796.8119 |
Chemical Identifiers
| CAS Number | 443644-29-9 |
|---|---|
| SMILES | CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=CS3)C(=O)N1 |
Product Overview
AF-399/41075286 (CAS 443644-29-9), with molecular formula C14H11N3O2S and molecular weight 285.06 g/mol. IUPAC: 2-amino-7-methyl-5-oxo-4-thiophen-2-yl-4,6-dihydropyrano[3,2-c]pyridine-3-carbonitrile.
Chemical Property Profile of AF-399/41075286
Property Insights of AF-399/41075286
The XLogP value of 1.963 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/41075286. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41075286. Following Lipinski's Rule of Five, AF-399/41075286 has 2 hydrogen bond donor(s) and 5 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-399/41075286?
The CAS number of AF-399/41075286 is 443644-29-9.
What is the molecular formula of AF-399/41075286?
The molecular formula of AF-399/41075286 is C14H11N3O2S.
What is the molecular weight of AF-399/41075286?
The molecular weight of AF-399/41075286 is 285.06 g/mol.
Where can I buy AF-399/41075286?
You can request a quote for AF-399/41075286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41075286?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41075286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.