![Benzothiazole, 2-[(4-morpholinylmethyl)thio]- structure](/static/products/854/85443-60-3.png)
Benzothiazole, 2-[(4-morpholinylmethyl)thio]-
TL;DR: Benzothiazole, 2-[(4-morpholinylmethyl)thio]- (CAS 85443-60-3) is a chemical compound with molecular formula C12H14N2OS2 and molecular weight 266.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzothiazol-2-ylsulfanylmethyl)morpholine
Also Known As: benzothiazole, 2-[(4-morpholinylmethyl)thio]-, 4-(1,3-benzothiazol-2-ylsulfanylmethyl)morpholine, Benzothiazole,2-[(4-morpholinylmethyl)thio]-, 2-{[(Morpholin-4-yl)methyl]sulfanyl}-1,3-benzothiazole
| Molecular Formula | C12H14N2OS2 |
|---|---|
| Molecular Weight | 266.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.05475 |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 85443-60-3 |
|---|---|
| SMILES | C1COCCN1CSC2=NC3=CC=CC=C3S2 |
| InChIKey | USLDGEPFWWDCKO-UHFFFAOYSA-N |
Product Overview
Benzothiazole, 2-[(4-morpholinylmethyl)thio]- (CAS 85443-60-3), with molecular formula C12H14N2OS2 and molecular weight 266.05 g/mol. IUPAC: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)morpholine.
Chemical Property Profile of Benzothiazole, 2-[(4-morpholinylmethyl)thio]-
Property Insights of Benzothiazole, 2-[(4-morpholinylmethyl)thio]-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzothiazole, 2-[(4-morpholinylmethyl)thio]-. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzothiazole, 2-[(4-morpholinylmethyl)thio]-. Following Lipinski's Rule of Five, Benzothiazole, 2-[(4-morpholinylmethyl)thio]- 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 Benzothiazole, 2-[(4-morpholinylmethyl)thio]-?
The CAS number of Benzothiazole, 2-[(4-morpholinylmethyl)thio]- is 85443-60-3.
What is the molecular formula of Benzothiazole, 2-[(4-morpholinylmethyl)thio]-?
The molecular formula of Benzothiazole, 2-[(4-morpholinylmethyl)thio]- is C12H14N2OS2.
What is the molecular weight of Benzothiazole, 2-[(4-morpholinylmethyl)thio]-?
The molecular weight of Benzothiazole, 2-[(4-morpholinylmethyl)thio]- is 266.05 g/mol.
Where can I buy Benzothiazole, 2-[(4-morpholinylmethyl)thio]-?
You can request a quote for Benzothiazole, 2-[(4-morpholinylmethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 2-[(4-morpholinylmethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 2-[(4-morpholinylmethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.