AF-399/15128548
TL;DR: AF-399/15128548 (CAS 315693-39-1) is a chemical compound with molecular formula C24H21N3O3S and molecular weight 431.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-N-[4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)phenyl]benzamide
Also Known As: AF-399/15128548, 3-methoxy-N-[4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)phenyl]benzamide, F0825-0459, 3-methoxy-N-(4-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)oxy)phenyl)benzamide, 3-methoxy-N-(4-{8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-yloxy}phenyl)benzamide
| Molecular Formula | C24H21N3O3S |
|---|---|
| Molecular Weight | 431.13 g/mol |
| LogP | 5.6233 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.13037 |
| Heavy Atoms | 31 |
| Complexity | 1250.907 |
Chemical Identifiers
| CAS Number | 315693-39-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC3=C4C5=C(CCCC5)SC4=NC=N3 |
Product Overview
AF-399/15128548 (CAS 315693-39-1), with molecular formula C24H21N3O3S and molecular weight 431.13 g/mol. IUPAC: 3-methoxy-N-[4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)phenyl]benzamide.
Chemical Property Profile of AF-399/15128548
Property Insights of AF-399/15128548
The XLogP value of 5.6233 indicates that AF-399/15128548 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15128548. Following Lipinski's Rule of Five, AF-399/15128548 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15128548?
The CAS number of AF-399/15128548 is 315693-39-1.
What is the molecular formula of AF-399/15128548?
The molecular formula of AF-399/15128548 is C24H21N3O3S.
What is the molecular weight of AF-399/15128548?
The molecular weight of AF-399/15128548 is 431.13 g/mol.
Where can I buy AF-399/15128548?
You can request a quote for AF-399/15128548 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15128548?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15128548 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.