11P-378S
TL;DR: 11P-378S (CAS 477709-33-4) is a chemical compound with molecular formula C24H22N6S and molecular weight 426.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole
Also Known As: 11P-378S, 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole, 4-methyl-3-[(4-methylbenzyl)sulfanyl]-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole, 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1,2,4-triazole, 4-methyl-3-{[(4-methylphenyl)methyl]sulfanyl}-5-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole
| Molecular Formula | C24H22N6S |
|---|---|
| Molecular Weight | 426.16 g/mol |
| LogP | 5.05922 |
| Topological Polar Surface Area | 53.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.16266 |
| Heavy Atoms | 31 |
| Complexity | 1284.1237 |
Chemical Identifiers
| CAS Number | 477709-33-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5 |
Product Overview
11P-378S (CAS 477709-33-4), with molecular formula C24H22N6S and molecular weight 426.16 g/mol. IUPAC: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-5-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1,2,4-triazole.
Chemical Property Profile of 11P-378S
Property Insights of 11P-378S
The XLogP value of 5.05922 indicates that 11P-378S 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-378S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11P-378S has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11P-378S?
The CAS number of 11P-378S is 477709-33-4.
What is the molecular formula of 11P-378S?
The molecular formula of 11P-378S is C24H22N6S.
What is the molecular weight of 11P-378S?
The molecular weight of 11P-378S is 426.16 g/mol.
Where can I buy 11P-378S?
You can request a quote for 11P-378S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11P-378S?
Yes, KEHONG BIO provides custom synthesis services for 11P-378S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.