![1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine structure](/static/products/7067/706772-34-1.webp)
1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine
TL;DR: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine (CAS 706772-34-1) is a chemical compound with molecular formula C23H22N6O4S2 and molecular weight 510.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine
Also Known As: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine, 1-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}-4-(naphthalen-2-ylsulfonyl)piperazine, 1-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-4-nitrophenyl}-4-(2-naphthylsulfonyl)piperazine
| Molecular Formula | C23H22N6O4S2 |
|---|---|
| Molecular Weight | 510.11 g/mol |
| LogP | 3.5386 |
| Topological Polar Surface Area | 114.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 510.1144 |
| Heavy Atoms | 35 |
| Complexity | 1513.4873 |
Chemical Identifiers
| CAS Number | 706772-34-1 |
|---|---|
| SMILES | CN1C=NN=C1SC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)[N+](=O)[O-] |
Product Overview
1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine (CAS 706772-34-1), with molecular formula C23H22N6O4S2 and molecular weight 510.11 g/mol. IUPAC: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine.
Chemical Property Profile of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine
Property Insights of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine
The XLogP value of 3.5386 indicates that 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine. Following Lipinski's Rule of Five, 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine?
The CAS number of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine is 706772-34-1.
What is the molecular formula of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine?
The molecular formula of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine is C23H22N6O4S2.
What is the molecular weight of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine?
The molecular weight of 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine is 510.11 g/mol.
Where can I buy 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine?
You can request a quote for 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.