AF-399/15128587
TL;DR: AF-399/15128587 (CAS 315693-88-0) is a chemical compound with molecular formula C21H17N3OS3 and molecular weight 423.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
Also Known As: AF-399/15128587, 2-methyl-4-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine, F0863-0496, 2-methyl-4-((2-methylthieno[3',2':5,6]benzo[1,2-d]thiazol-5-yl)oxy)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine, 5-methyl-3-({4-methyl-5,12-dithia-3-azatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),3,7,10-pentaen-8-yl}oxy)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraene
| Molecular Formula | C21H17N3OS3 |
|---|---|
| Molecular Weight | 423.05 g/mol |
| LogP | 6.80364 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 423.05338 |
| Heavy Atoms | 28 |
| Complexity | 1378.6019 |
Chemical Identifiers
| CAS Number | 315693-88-0 |
|---|---|
| SMILES | CC1=NC(=C2C3=C(CCCC3)SC2=N1)OC4=CC5=C(C6=C4C=CS6)N=C(S5)C |
Product Overview
AF-399/15128587 (CAS 315693-88-0), with molecular formula C21H17N3OS3 and molecular weight 423.05 g/mol. IUPAC: 2-methyl-4-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine.
Chemical Property Profile of AF-399/15128587
Property Insights of AF-399/15128587
The XLogP value of 6.80364 indicates that AF-399/15128587 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, AF-399/15128587 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/15128587 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15128587?
The CAS number of AF-399/15128587 is 315693-88-0.
What is the molecular formula of AF-399/15128587?
The molecular formula of AF-399/15128587 is C21H17N3OS3.
What is the molecular weight of AF-399/15128587?
The molecular weight of AF-399/15128587 is 423.05 g/mol.
Where can I buy AF-399/15128587?
You can request a quote for AF-399/15128587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15128587?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15128587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.