AF-399/15335158
TL;DR: AF-399/15335158 (CAS 374693-25-1) is a chemical compound with molecular formula C20H18N4OS3 and molecular weight 426.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide
Also Known As: AF-399/15335158, F1143-2056, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-2-[(2-methyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide, N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-2-({10-methyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9,11-tetraen-12-yl}sulfanyl)acetamide, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-((2-methyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)acetamide
| Molecular Formula | C20H18N4OS3 |
|---|---|
| Molecular Weight | 426.06 g/mol |
| LogP | 4.6411 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.06427 |
| Heavy Atoms | 28 |
| Complexity | 1154.8478 |
Chemical Identifiers
| CAS Number | 374693-25-1 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCC3)C(=N1)SCC(=O)NC4=C(C5=C(S4)CCC5)C#N |
Product Overview
AF-399/15335158 (CAS 374693-25-1), with molecular formula C20H18N4OS3 and molecular weight 426.06 g/mol. IUPAC: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide.
Chemical Property Profile of AF-399/15335158
Property Insights of AF-399/15335158
The XLogP value of 4.6411 indicates that AF-399/15335158 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15335158. Following Lipinski's Rule of Five, AF-399/15335158 has 1 hydrogen bond donor(s) and 7 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-399/15335158?
The CAS number of AF-399/15335158 is 374693-25-1.
What is the molecular formula of AF-399/15335158?
The molecular formula of AF-399/15335158 is C20H18N4OS3.
What is the molecular weight of AF-399/15335158?
The molecular weight of AF-399/15335158 is 426.06 g/mol.
Where can I buy AF-399/15335158?
You can request a quote for AF-399/15335158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15335158?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15335158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.