11P-379S
TL;DR: 11P-379S (CAS 477709-34-5) is a chemical compound with molecular formula C24H22N6OS and molecular weight 442.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole
Also Known As: 11P-379S, methyl 4-[({4-methyl-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl ether, 3-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole, 3-{[(4-methoxyphenyl)methyl]sulfanyl}-4-methyl-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole
| Molecular Formula | C24H22N6OS |
|---|---|
| Molecular Weight | 442.16 g/mol |
| LogP | 4.7594 |
| Topological Polar Surface Area | 62.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.1576 |
| Heavy Atoms | 32 |
| Complexity | 1306.8125 |
Chemical Identifiers
| CAS Number | 477709-34-5 |
|---|---|
| SMILES | CN1C(=NN=C1SCC2=CC=C(C=C2)OC)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5 |
Product Overview
11P-379S (CAS 477709-34-5), with molecular formula C24H22N6OS and molecular weight 442.16 g/mol. IUPAC: 3-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole.
Chemical Property Profile of 11P-379S
Property Insights of 11P-379S
The XLogP value of 4.7594 indicates that 11P-379S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 11P-379S. Following Lipinski's Rule of Five, 11P-379S has 0 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 11P-379S?
The CAS number of 11P-379S is 477709-34-5.
What is the molecular formula of 11P-379S?
The molecular formula of 11P-379S is C24H22N6OS.
What is the molecular weight of 11P-379S?
The molecular weight of 11P-379S is 442.16 g/mol.
Where can I buy 11P-379S?
You can request a quote for 11P-379S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11P-379S?
Yes, KEHONG BIO provides custom synthesis services for 11P-379S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.