AF-399/41048280
TL;DR: AF-399/41048280 (CAS 384350-33-8) is a chemical compound with molecular formula C21H26N6S and molecular weight 394.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
Also Known As: AF-399/41048280, 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine, 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-6-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine, 4-[4-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinyl]-6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine, 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
| Molecular Formula | C21H26N6S |
|---|---|
| Molecular Weight | 394.19 g/mol |
| LogP | 3.54954 |
| Topological Polar Surface Area | 58.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 394.19397 |
| Heavy Atoms | 28 |
| Complexity | 1000.9029 |
Chemical Identifiers
| CAS Number | 384350-33-8 |
|---|---|
| SMILES | CC1CCC2=C(C1)C3=C(N=CN=C3S2)N4CCN(CC4)C5=NC(=CC(=N5)C)C |
Product Overview
AF-399/41048280 (CAS 384350-33-8), with molecular formula C21H26N6S and molecular weight 394.19 g/mol. IUPAC: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine.
Chemical Property Profile of AF-399/41048280
Property Insights of AF-399/41048280
The XLogP value of 3.54954 indicates that AF-399/41048280 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.04 Ų, AF-399/41048280 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/41048280 has 0 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-399/41048280?
The CAS number of AF-399/41048280 is 384350-33-8.
What is the molecular formula of AF-399/41048280?
The molecular formula of AF-399/41048280 is C21H26N6S.
What is the molecular weight of AF-399/41048280?
The molecular weight of AF-399/41048280 is 394.19 g/mol.
Where can I buy AF-399/41048280?
You can request a quote for AF-399/41048280 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41048280?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41048280 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.