HIV-1 inhibitor-46
TL;DR: HIV-1 inhibitor-46 (CAS 332947-35-0) is a chemical compound with molecular formula C24H21ClN4OS and molecular weight 448.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-benzyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide
Also Known As: HIV-1 inhibitor-46, HIV-1-inhibitor-46, BAS 02053338, 2-[[5-benzyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide, 2-[[5-benzyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide
| Molecular Formula | C24H21ClN4OS |
|---|---|
| Molecular Weight | 448.11 g/mol |
| LogP | 5.55072 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 448.11246 |
| Heavy Atoms | 31 |
| Complexity | 1175.9258 |
Chemical Identifiers
| CAS Number | 332947-35-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3Cl)CC4=CC=CC=C4 |
Product Overview
HIV-1 inhibitor-46 (CAS 332947-35-0), with molecular formula C24H21ClN4OS and molecular weight 448.11 g/mol. IUPAC: 2-[[5-benzyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide.
Chemical Property Profile of HIV-1 inhibitor-46
Property Insights of HIV-1 inhibitor-46
The XLogP value of 5.55072 indicates that HIV-1 inhibitor-46 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, HIV-1 inhibitor-46 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, HIV-1 inhibitor-46 has 1 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 HIV-1 inhibitor-46?
The CAS number of HIV-1 inhibitor-46 is 332947-35-0.
What is the molecular formula of HIV-1 inhibitor-46?
The molecular formula of HIV-1 inhibitor-46 is C24H21ClN4OS.
What is the molecular weight of HIV-1 inhibitor-46?
The molecular weight of HIV-1 inhibitor-46 is 448.11 g/mol.
Where can I buy HIV-1 inhibitor-46?
You can request a quote for HIV-1 inhibitor-46 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for HIV-1 inhibitor-46?
Yes, KEHONG BIO provides custom synthesis services for HIV-1 inhibitor-46 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.