2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone
TL;DR: 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone (CAS 438235-47-3) is a chemical compound with molecular formula C19H20N2O6S2 and molecular weight 436.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone
Also Known As: 2-(3-benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone, 4-[({3-(benzylsulfonyl)-5-nitrophenyl}sulfanyl)acetyl]morpholine, 2-{[3-(benzylsulfonyl)-5-nitrophenyl]sulfanyl}-1-(morpholin-4-yl)ethanone, 2-{[3-(BENZYLSULFONYL)-5-NITROPHENYL]SULFANYL}-1-MORPHOLINO-1-ETHANONE
| Molecular Formula | C19H20N2O6S2 |
|---|---|
| Molecular Weight | 436.08 g/mol |
| LogP | 2.5196 |
| Topological Polar Surface Area | 106.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 436.0763 |
| Heavy Atoms | 29 |
| Complexity | 989.01385 |
Chemical Identifiers
| CAS Number | 438235-47-3 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC2=CC(=CC(=C2)[N+](=O)[O-])S(=O)(=O)CC3=CC=CC=C3 |
Product Overview
2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone (CAS 438235-47-3), with molecular formula C19H20N2O6S2 and molecular weight 436.08 g/mol. IUPAC: 2-(3-benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone
Property Insights of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone
The XLogP value of 2.5196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone. The TPSA of 106.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone. Following Lipinski's Rule of Five, 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone has 0 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 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone?
The CAS number of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone is 438235-47-3.
What is the molecular formula of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone?
The molecular formula of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone is C19H20N2O6S2.
What is the molecular weight of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone?
The molecular weight of 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone is 436.08 g/mol.
Where can I buy 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone?
You can request a quote for 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Benzylsulfonyl-5-nitrophenyl)sulfanyl-1-morpholin-4-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.