AF-399/41899617
TL;DR: AF-399/41899617 (CAS 618075-71-1) is a chemical compound with molecular formula C18H19BrN2O4S and molecular weight 438.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(5-bromo-2-methoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AF-399/41899617, methyl 5-(5-bromo-2-methoxyphenyl)-2-ethyl-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, Methyl 5-(5-bromo-2-methoxyphenyl)-2-ethyl-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, methyl 5-(5-bromo-2-methoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, 645-815-8
| Molecular Formula | C18H19BrN2O4S |
|---|---|
| Molecular Weight | 438.02 g/mol |
| LogP | 3.6694 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.0249 |
| Heavy Atoms | 26 |
| Complexity | 836.48004 |
Chemical Identifiers
| CAS Number | 618075-71-1 |
|---|---|
| SMILES | CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OC)C3=C(C=CC(=C3)Br)OC |
Product Overview
AF-399/41899617 (CAS 618075-71-1), with molecular formula C18H19BrN2O4S and molecular weight 438.02 g/mol. IUPAC: methyl 5-(5-bromo-2-methoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AF-399/41899617
Property Insights of AF-399/41899617
The XLogP value of 3.6694 indicates that AF-399/41899617 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41899617. Following Lipinski's Rule of Five, AF-399/41899617 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-399/41899617?
The CAS number of AF-399/41899617 is 618075-71-1.
What is the molecular formula of AF-399/41899617?
The molecular formula of AF-399/41899617 is C18H19BrN2O4S.
What is the molecular weight of AF-399/41899617?
The molecular weight of AF-399/41899617 is 438.02 g/mol.
Where can I buy AF-399/41899617?
You can request a quote for AF-399/41899617 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41899617?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41899617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.