![1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine structure](/static/products/898/898050-20-9.png)
1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine
TL;DR: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine (CAS 898050-20-9) is a chemical compound with molecular formula C25H29N5O4S and molecular weight 495.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine
Also Known As: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine, 1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine
| Molecular Formula | C25H29N5O4S |
|---|---|
| Molecular Weight | 495.19 g/mol |
| LogP | 3.78704 |
| Topological Polar Surface Area | 101.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.19403 |
| Heavy Atoms | 35 |
| Complexity | 1390.8339 |
Chemical Identifiers
| CAS Number | 898050-20-9 |
|---|---|
| SMILES | CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(CCCC5)C=C4)[N+](=O)[O-])C |
Product Overview
1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine (CAS 898050-20-9), with molecular formula C25H29N5O4S and molecular weight 495.19 g/mol. IUPAC: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine.
Chemical Property Profile of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine
Property Insights of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine
The XLogP value of 3.78704 indicates that 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine. Following Lipinski's Rule of Five, 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine 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 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine?
The CAS number of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine is 898050-20-9.
What is the molecular formula of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine?
The molecular formula of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine is C25H29N5O4S.
What is the molecular weight of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine?
The molecular weight of 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine is 495.19 g/mol.
Where can I buy 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine?
You can request a quote for 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.