2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol
TL;DR: 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol (CAS 329922-59-0) is a chemical compound with molecular formula C12H16N2O4S and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-morpholin-4-yl-2-nitrophenyl)sulfanylethanol
Also Known As: BAS 00327021, 2-(5-morpholin-4-yl-2-nitrophenyl)sulfanylethanol, 2-((5-morpholino-2-nitrophenyl)thio)ethanol, 2-(5-Morpholin-4-yl-2-nitro-phenylsulfanyl)-ethanol, 2-(5-morpholin-4-yl-2-nitrophenylthio)ethan-1-ol
| Molecular Formula | C12H16N2O4S |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.08307 |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 329922-59-0 |
|---|---|
| SMILES | C1COCCN1C2=CC(=C(C=C2)[N+](=O)[O-])SCCO |
| InChIKey | UKNUPIJRXPWQFJ-UHFFFAOYSA-N |
Product Overview
2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol (CAS 329922-59-0), with molecular formula C12H16N2O4S and molecular weight 284.08 g/mol. IUPAC: 2-(5-morpholin-4-yl-2-nitrophenyl)sulfanylethanol.
Chemical Property Profile of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol
Property Insights of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol. Following Lipinski's Rule of Five, 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol 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-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol?
The CAS number of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol is 329922-59-0.
What is the molecular formula of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol?
The molecular formula of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol is C12H16N2O4S.
What is the molecular weight of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol?
The molecular weight of 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol is 284.08 g/mol.
Where can I buy 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol?
You can request a quote for 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Morpholin-4-yl-2-nitrophenyl)sulfanylethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.