11P-377S
TL;DR: 11P-377S (CAS 477709-32-3) is a chemical compound with molecular formula C23H19N7O2S and molecular weight 457.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole
Also Known As: 11P-377S, 4-methyl-3-[(4-nitrobenzyl)sulfanyl]-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole, 4-methyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole, 4-methyl-3-{[(4-nitrophenyl)methyl]sulfanyl}-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole, 4-methyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1,2,4-triazole
| Molecular Formula | C23H19N7O2S |
|---|---|
| Molecular Weight | 457.13 g/mol |
| LogP | 4.659 |
| Topological Polar Surface Area | 96.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.13208 |
| Heavy Atoms | 33 |
| Complexity | 1390.8887 |
Chemical Identifiers
| CAS Number | 477709-32-3 |
|---|---|
| SMILES | CN1C(=NN=C1SCC2=CC=C(C=C2)[N+](=O)[O-])C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5 |
Product Overview
11P-377S (CAS 477709-32-3), with molecular formula C23H19N7O2S and molecular weight 457.13 g/mol. IUPAC: 4-methyl-3-[(4-nitrophenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole.
Chemical Property Profile of 11P-377S
Property Insights of 11P-377S
The XLogP value of 4.659 indicates that 11P-377S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 11P-377S. Following Lipinski's Rule of Five, 11P-377S has 0 hydrogen bond donor(s) and 6 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-377S?
The CAS number of 11P-377S is 477709-32-3.
What is the molecular formula of 11P-377S?
The molecular formula of 11P-377S is C23H19N7O2S.
What is the molecular weight of 11P-377S?
The molecular weight of 11P-377S is 457.13 g/mol.
Where can I buy 11P-377S?
You can request a quote for 11P-377S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11P-377S?
Yes, KEHONG BIO provides custom synthesis services for 11P-377S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.