F1308-0028
TL;DR: F1308-0028 (CAS 496776-21-7) is a chemical compound with molecular formula C21H17N5O3S and molecular weight 419.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine
Also Known As: F1308-0028, 3-[4-(4-methoxyphenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine, 3-(4-(4-methoxyphenyl)-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine, 3-[4-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine, 3-{4-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
| Molecular Formula | C21H17N5O3S |
|---|---|
| Molecular Weight | 419.11 g/mol |
| LogP | 4.5384 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 419.10522 |
| Heavy Atoms | 30 |
| Complexity | 1145.7476 |
Chemical Identifiers
| CAS Number | 496776-21-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)[N+](=O)[O-])C4=CN=CC=C4 |
Product Overview
F1308-0028 (CAS 496776-21-7), with molecular formula C21H17N5O3S and molecular weight 419.11 g/mol. IUPAC: 3-[4-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine.
Chemical Property Profile of F1308-0028
Property Insights of F1308-0028
The XLogP value of 4.5384 indicates that F1308-0028 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for F1308-0028. Following Lipinski's Rule of Five, F1308-0028 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 F1308-0028?
The CAS number of F1308-0028 is 496776-21-7.
What is the molecular formula of F1308-0028?
The molecular formula of F1308-0028 is C21H17N5O3S.
What is the molecular weight of F1308-0028?
The molecular weight of F1308-0028 is 419.11 g/mol.
Where can I buy F1308-0028?
You can request a quote for F1308-0028 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1308-0028?
Yes, KEHONG BIO provides custom synthesis services for F1308-0028 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.