2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide
TL;DR: 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide (CAS 898654-44-9) is a chemical compound with molecular formula C12H16ClN3O5S and molecular weight 349.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide
Also Known As: VU0606839-1, F3237-0157, 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide, [(2-chloro-5-nitrophenyl)sulfonyl](2-morpholin-4-ylethyl)amine, 2-chloro-N-(2-morpholinoethyl)-5-nitrobenzenesulfonamide
| Molecular Formula | C12H16ClN3O5S |
|---|---|
| Molecular Weight | 349.05 g/mol |
| LogP | 0.8587 |
| Topological Polar Surface Area | 101.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.04993 |
| Heavy Atoms | 22 |
| Complexity | 646.16187 |
Chemical Identifiers
| CAS Number | 898654-44-9 |
|---|---|
| SMILES | C1COCCN1CCNS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl |
Product Overview
2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide (CAS 898654-44-9), with molecular formula C12H16ClN3O5S and molecular weight 349.05 g/mol. IUPAC: 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide.
Chemical Property Profile of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide
Property Insights of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide
The XLogP value of 0.8587 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide. The TPSA of 101.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide has 1 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 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide?
The CAS number of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide is 898654-44-9.
What is the molecular formula of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide?
The molecular formula of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide is C12H16ClN3O5S.
What is the molecular weight of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide?
The molecular weight of 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide is 349.05 g/mol.
Where can I buy 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide?
You can request a quote for 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2-morpholin-4-ylethyl)-5-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.