N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline
TL;DR: N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline (CAS 347310-85-4) is a chemical compound with molecular formula C16H20N4O5S and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline
Also Known As: AB00109965-01, A2614/0111135, N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline, N-(furan-2-ylmethyl)-5-(4-(methylsulfonyl)piperazin-1-yl)-2-nitroaniline, N-(furan-2-ylmethyl)-5-[4-(methylsulfonyl)piperazin-1-yl]-2-nitroaniline
| Molecular Formula | C16H20N4O5S |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 1.8815 |
| Topological Polar Surface Area | 108.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.11545 |
| Heavy Atoms | 26 |
| Complexity | 874.05 |
Chemical Identifiers
| CAS Number | 347310-85-4 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3 |
Product Overview
N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline (CAS 347310-85-4), with molecular formula C16H20N4O5S and molecular weight 380.12 g/mol. IUPAC: N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline.
Chemical Property Profile of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline
Property Insights of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline
The XLogP value of 1.8815 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline. The TPSA of 108.93 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline. Following Lipinski's Rule of Five, N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline has 1 hydrogen bond donor(s) and 7 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 N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline?
The CAS number of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline is 347310-85-4.
What is the molecular formula of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline?
The molecular formula of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline is C16H20N4O5S.
What is the molecular weight of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline?
The molecular weight of N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline is 380.12 g/mol.
Where can I buy N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline?
You can request a quote for N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(furan-2-ylmethyl)-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.