11P-376S
TL;DR: 11P-376S (CAS 477709-31-2) is a chemical compound with molecular formula C23H19FN6S and molecular weight 430.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole
Also Known As: 11P-376S, 4-fluorobenzyl 4-methyl-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl sulfide, 3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole, 3-{[(4-fluorophenyl)methyl]sulfanyl}-4-methyl-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole, 3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1,2,4-triazole
| Molecular Formula | C23H19FN6S |
|---|---|
| Molecular Weight | 430.14 g/mol |
| LogP | 4.8899 |
| Topological Polar Surface Area | 53.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.1376 |
| Heavy Atoms | 31 |
| Complexity | 1290.1208 |
Chemical Identifiers
| CAS Number | 477709-31-2 |
|---|---|
| SMILES | CN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5 |
Product Overview
11P-376S (CAS 477709-31-2), with molecular formula C23H19FN6S and molecular weight 430.14 g/mol. IUPAC: 3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole.
Chemical Property Profile of 11P-376S
Property Insights of 11P-376S
The XLogP value of 4.8899 indicates that 11P-376S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.46 Ų, 11P-376S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11P-376S has 0 hydrogen bond donor(s) and 4 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-376S?
The CAS number of 11P-376S is 477709-31-2.
What is the molecular formula of 11P-376S?
The molecular formula of 11P-376S is C23H19FN6S.
What is the molecular weight of 11P-376S?
The molecular weight of 11P-376S is 430.14 g/mol.
Where can I buy 11P-376S?
You can request a quote for 11P-376S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11P-376S?
Yes, KEHONG BIO provides custom synthesis services for 11P-376S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.