F2527-0075
TL;DR: F2527-0075 (CAS 877643-16-8) is a chemical compound with molecular formula C13H11ClN4O5S and molecular weight 370.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-methyl-3-methylsulfanyl-5-oxo-1,2,4-triazin-4-yl)methyl 5-chloro-2-nitrobenzoate
Also Known As: F2527-0075, [6-methyl-3-(methylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-4-yl]methyl 5-chloro-2-nitrobenzoate, (6-methyl-3-(methylthio)-5-oxo-1,2,4-triazin-4(5H)-yl)methyl 5-chloro-2-nitrobenzoate, (6-methyl-3-methylsulfanyl-5-oxo-1,2,4-triazin-4-yl)methyl 5-chloro-2-nitrobenzoate
| Molecular Formula | C13H11ClN4O5S |
|---|---|
| Molecular Weight | 370.01 g/mol |
| LogP | 2.04472 |
| Topological Polar Surface Area | 117.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.01385 |
| Heavy Atoms | 24 |
| Complexity | 869.92596 |
Chemical Identifiers
| CAS Number | 877643-16-8 |
|---|---|
| SMILES | CC1=NN=C(N(C1=O)COC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])SC |
Product Overview
F2527-0075 (CAS 877643-16-8), with molecular formula C13H11ClN4O5S and molecular weight 370.01 g/mol. IUPAC: (6-methyl-3-methylsulfanyl-5-oxo-1,2,4-triazin-4-yl)methyl 5-chloro-2-nitrobenzoate.
Chemical Property Profile of F2527-0075
Property Insights of F2527-0075
The XLogP value of 2.04472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2527-0075. The TPSA of 117.22 Ų falls within the moderate polarity range, balancing permeability and solubility for F2527-0075. Following Lipinski's Rule of Five, F2527-0075 has 0 hydrogen bond donor(s) and 8 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 F2527-0075?
The CAS number of F2527-0075 is 877643-16-8.
What is the molecular formula of F2527-0075?
The molecular formula of F2527-0075 is C13H11ClN4O5S.
What is the molecular weight of F2527-0075?
The molecular weight of F2527-0075 is 370.01 g/mol.
Where can I buy F2527-0075?
You can request a quote for F2527-0075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2527-0075?
Yes, KEHONG BIO provides custom synthesis services for F2527-0075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.