AF-399/13278034
TL;DR: AF-399/13278034 (CAS 385398-25-4) is a chemical compound with molecular formula C16H18BrFN2O3 and molecular weight 384.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 6-(3-bromo-4-fluorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: AF-399/13278034, isopropyl 4-(3-bromo-4-fluorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, propan-2-yl 6-(3-bromo-4-fluorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
| Molecular Formula | C16H18BrFN2O3 |
|---|---|
| Molecular Weight | 384.05 g/mol |
| LogP | 3.5099 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.0485 |
| Heavy Atoms | 23 |
| Complexity | 687.90295 |
Chemical Identifiers
| CAS Number | 385398-25-4 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC(=C(C=C2)F)Br)C(=O)OC(C)C |
Product Overview
AF-399/13278034 (CAS 385398-25-4), with molecular formula C16H18BrFN2O3 and molecular weight 384.05 g/mol. IUPAC: propan-2-yl 6-(3-bromo-4-fluorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of AF-399/13278034
Property Insights of AF-399/13278034
The XLogP value of 3.5099 indicates that AF-399/13278034 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AF-399/13278034 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/13278034 has 1 hydrogen bond donor(s) and 3 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-399/13278034?
The CAS number of AF-399/13278034 is 385398-25-4.
What is the molecular formula of AF-399/13278034?
The molecular formula of AF-399/13278034 is C16H18BrFN2O3.
What is the molecular weight of AF-399/13278034?
The molecular weight of AF-399/13278034 is 384.05 g/mol.
Where can I buy AF-399/13278034?
You can request a quote for AF-399/13278034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/13278034?
Yes, KEHONG BIO provides custom synthesis services for AF-399/13278034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.