![4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine structure](/static/products/5405/540514-34-9.webp)
4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine
TL;DR: 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine (CAS 540514-34-9) is a chemical compound with molecular formula C12H14N2O3S3 and molecular weight 330.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine
Also Known As: 2-methylthio-5-(morpholin-4-ylsulfonyl)benzothiazole, 4-[(2-methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine, 2-(methylthio)-5-(4-morpholinylsulfonyl)-1,3-benzothiazole, 2-(methylsulfanyl)-5-(morpholin-4-ylsulfonyl)-1,3-benzothiazole
| Molecular Formula | C12H14N2O3S3 |
|---|---|
| Molecular Weight | 330.02 g/mol |
| LogP | 2.0391 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.01666 |
| Heavy Atoms | 20 |
| Complexity | 720.6228 |
Chemical Identifiers
| CAS Number | 540514-34-9 |
|---|---|
| SMILES | CSC1=NC2=C(S1)C=CC(=C2)S(=O)(=O)N3CCOCC3 |
Product Overview
4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine (CAS 540514-34-9), with molecular formula C12H14N2O3S3 and molecular weight 330.02 g/mol. IUPAC: 4-[(2-methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine.
Chemical Property Profile of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine
Property Insights of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine
The XLogP value of 2.0391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine. With a topological polar surface area (TPSA) of 59.5 Ų, 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine 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 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine?
The CAS number of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine is 540514-34-9.
What is the molecular formula of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine?
The molecular formula of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine is C12H14N2O3S3.
What is the molecular weight of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine?
The molecular weight of 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine is 330.02 g/mol.
Where can I buy 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine?
You can request a quote for 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Methylsulfanyl-1,3-benzothiazol-5-yl)sulfonyl]morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.