9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole
TL;DR: 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole (CAS 1164544-37-9) is a chemical compound with molecular formula C22H27N3O6S and molecular weight 461.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-ethyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]carbazole;oxalic acid
Also Known As: 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole, 9-ethyl-3-((4-(methylsulfonyl)piperazin-1-yl)methyl)-9H-carbazole oxalate, 9-ethyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]carbazole; oxalic acid
| Molecular Formula | C22H27N3O6S |
|---|---|
| Molecular Weight | 461.16 g/mol |
| LogP | 2.0472 |
| Topological Polar Surface Area | 120.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 461.16205 |
| Heavy Atoms | 32 |
| Complexity | 1231.2677 |
Chemical Identifiers
| CAS Number | 1164544-37-9 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)CN3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C41.C(=O)(C(=O)O)O |
Product Overview
9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole (CAS 1164544-37-9), with molecular formula C22H27N3O6S and molecular weight 461.16 g/mol. IUPAC: 9-ethyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]carbazole;oxalic acid.
Chemical Property Profile of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole
Property Insights of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole
The XLogP value of 2.0472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole. The TPSA of 120.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole. Following Lipinski's Rule of Five, 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole has 2 hydrogen bond donor(s) and 5 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 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole?
The CAS number of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole is 1164544-37-9.
What is the molecular formula of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole?
The molecular formula of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole is C22H27N3O6S.
What is the molecular weight of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole?
The molecular weight of 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole is 461.16 g/mol.
Where can I buy 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole?
You can request a quote for 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole?
Yes, KEHONG BIO provides custom synthesis services for 9-Ethyl-3-(4-methanesulfonyl-piperazin-1-ylmethyl)-9H-carbazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.