(3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone
TL;DR: (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone (CAS 339276-57-2) is a chemical compound with molecular formula C18H17ClN2O6S and molecular weight 424.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-morpholin-4-ylmethanone
Also Known As: (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone, 4J-952, [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-morpholin-4-ylmethanone, 4-{3-[(4-chlorobenzenesulfonyl)methyl]-4-nitrobenzoyl}morpholine, (3-{[(4-chlorophenyl)sulfonyl]methyl}-4-nitrophenyl)(morpholino)methanone
| Molecular Formula | C18H17ClN2O6S |
|---|---|
| Molecular Weight | 424.05 g/mol |
| LogP | 2.6945 |
| Topological Polar Surface Area | 106.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.0496 |
| Heavy Atoms | 28 |
| Complexity | 1001.23596 |
Chemical Identifiers
| CAS Number | 339276-57-2 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
(3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone (CAS 339276-57-2), with molecular formula C18H17ClN2O6S and molecular weight 424.05 g/mol. IUPAC: [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-morpholin-4-ylmethanone.
Chemical Property Profile of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone
Property Insights of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone
The XLogP value of 2.6945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone. The TPSA of 106.82 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone. Following Lipinski's Rule of Five, (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone 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 (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone?
The CAS number of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone is 339276-57-2.
What is the molecular formula of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone?
The molecular formula of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone is C18H17ClN2O6S.
What is the molecular weight of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone?
The molecular weight of (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone is 424.05 g/mol.
Where can I buy (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone?
You can request a quote for (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-(((4-Chlorophenyl)sulfonyl)methyl)-4-nitrophenyl)(morpholino)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.