2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one
TL;DR: 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one (CAS 393519-00-1) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylsulfanyl)-1-morpholin-4-ylethanone
Also Known As: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one, 2-(benzo[d]oxazol-2-ylthio)-1-morpholinoethanone, 2-(1,3-benzoxazol-2-ylsulfanyl)-1-morpholin-4-ylethanone, 2-benzoxazol-2-ylthio-1-morpholin-4-ylethan-1-one, 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 393519-00-1 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC2=NC3=CC=CC=C3O2 |
| InChIKey | GIKBTBYHAVXMBL-UHFFFAOYSA-N |
Product Overview
2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one (CAS 393519-00-1), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one
Property Insights of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one. Following Lipinski's Rule of Five, 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one has 0 hydrogen bond donor(s) and 5 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-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one?
The CAS number of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one is 393519-00-1.
What is the molecular formula of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one?
The molecular formula of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one is C13H14N2O3S.
What is the molecular weight of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one?
The molecular weight of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one is 278.07 g/mol.
Where can I buy 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one?
You can request a quote for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.