F3098-4946
TL;DR: F3098-4946 (CAS 496040-05-2) is a chemical compound with molecular formula C16H17ClN4O2 and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 7-(2-chlorophenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: F3098-4946, propan-2-yl 7-(2-chlorophenyl)-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, isopropyl 7-(2-chlorophenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, methylethyl 7-(2-chlorophenyl)-5-methyl-4,7,8-trihydro-1,2,4-triazolo[1,5-a]py rimidine-6-carboxylate, propan-2-yl 7-(2-chlorophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
| Molecular Formula | C16H17ClN4O2 |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 3.172 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.104 |
| Heavy Atoms | 23 |
| Complexity | 781.89233 |
Chemical Identifiers
| CAS Number | 496040-05-2 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC=N2)N1)C3=CC=CC=C3Cl)C(=O)OC(C)C |
Product Overview
F3098-4946 (CAS 496040-05-2), with molecular formula C16H17ClN4O2 and molecular weight 332.10 g/mol. IUPAC: propan-2-yl 7-(2-chlorophenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate.
Chemical Property Profile of F3098-4946
Property Insights of F3098-4946
The XLogP value of 3.172 indicates that F3098-4946 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F3098-4946. Following Lipinski's Rule of Five, F3098-4946 has 1 hydrogen bond donor(s) and 5 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 F3098-4946?
The CAS number of F3098-4946 is 496040-05-2.
What is the molecular formula of F3098-4946?
The molecular formula of F3098-4946 is C16H17ClN4O2.
What is the molecular weight of F3098-4946?
The molecular weight of F3098-4946 is 332.10 g/mol.
Where can I buy F3098-4946?
You can request a quote for F3098-4946 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3098-4946?
Yes, KEHONG BIO provides custom synthesis services for F3098-4946 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.