![3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate structure](/static/products/116/1164562-71-3.png)
3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate
TL;DR: 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate (CAS 1164562-71-3) is a chemical compound with molecular formula C28H31N3O6S and molecular weight 537.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-9-ethylcarbazole;oxalic acid
Also Known As: 3-((4-(benzylsulfonyl)piperazin-1-yl)methyl)-9-ethyl-9H-carbazole oxalate, 3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-9-ethylcarbazole; oxalic acid, 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate
| Molecular Formula | C28H31N3O6S |
|---|---|
| Molecular Weight | 537.19 g/mol |
| LogP | 3.6176 |
| Topological Polar Surface Area | 120.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 537.19336 |
| Heavy Atoms | 38 |
| Complexity | 1529.168 |
Chemical Identifiers
| CAS Number | 1164562-71-3 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C5=CC=CC=C51.C(=O)(C(=O)O)O |
Product Overview
3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate (CAS 1164562-71-3), with molecular formula C28H31N3O6S and molecular weight 537.19 g/mol. IUPAC: 3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-9-ethylcarbazole;oxalic acid.
Chemical Property Profile of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate
Property Insights of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate
The XLogP value of 3.6176 indicates that 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate. Following Lipinski's Rule of Five, 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate?
The CAS number of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate is 1164562-71-3.
What is the molecular formula of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate?
The molecular formula of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate is C28H31N3O6S.
What is the molecular weight of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate?
The molecular weight of 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate is 537.19 g/mol.
Where can I buy 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate?
You can request a quote for 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate?
Yes, KEHONG BIO provides custom synthesis services for 3-{[4-(benzylsulfonyl)-1-piperazinyl]methyl}-9-ethyl-9H-carbazole oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.