AF-399/40806212
TL;DR: AF-399/40806212 (CAS 379243-16-0) is a chemical compound with molecular formula C22H22N4O2S2 and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-4-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine
Also Known As: AF-399/40806212, 5,6-dimethyl-4-[4-(naphthalen-2-ylsulfonyl)piperazin-1-yl]thieno[2,3-d]pyrimidine, 4-(5,6-dimethylthiopheno[3,2-e]pyrimidin-4-yl)-1-(2-naphthylsulfonyl)piperazin e, 5,6-dimethyl-4-[4-(2-naphthylsulfonyl)-1-piperazinyl]thieno[2,3-d]pyrimidine
| Molecular Formula | C22H22N4O2S2 |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 3.97224 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 438.1184 |
| Heavy Atoms | 30 |
| Complexity | 1356.3433 |
Chemical Identifiers
| CAS Number | 379243-16-0 |
|---|---|
| SMILES | CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C |
Product Overview
AF-399/40806212 (CAS 379243-16-0), with molecular formula C22H22N4O2S2 and molecular weight 438.12 g/mol. IUPAC: 5,6-dimethyl-4-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine.
Chemical Property Profile of AF-399/40806212
Property Insights of AF-399/40806212
The XLogP value of 3.97224 indicates that AF-399/40806212 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40806212. Following Lipinski's Rule of Five, AF-399/40806212 has 0 hydrogen bond donor(s) and 6 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-399/40806212?
The CAS number of AF-399/40806212 is 379243-16-0.
What is the molecular formula of AF-399/40806212?
The molecular formula of AF-399/40806212 is C22H22N4O2S2.
What is the molecular weight of AF-399/40806212?
The molecular weight of AF-399/40806212 is 438.12 g/mol.
Where can I buy AF-399/40806212?
You can request a quote for AF-399/40806212 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40806212?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40806212 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.