(6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid
TL;DR: (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid (CAS 436088-91-4) is a chemical compound with molecular formula C11H10N2O3S2 and molecular weight 282.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]acetic acid
Also Known As: -ACETICACID, (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid, TIMTEC-BB SBB012227, BAS 04080535, 3452AE
| Molecular Formula | C11H10N2O3S2 |
|---|---|
| Molecular Weight | 282.01 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.01328 |
| Heavy Atoms | 18 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 436088-91-4 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)O |
| InChIKey | DSRHSCKCDGMHEA-UHFFFAOYSA-N |
Product Overview
(6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid (CAS 436088-91-4), with molecular formula C11H10N2O3S2 and molecular weight 282.01 g/mol. IUPAC: 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]acetic acid.
Chemical Property Profile of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid
Property Insights of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid. Following Lipinski's Rule of Five, (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid has 2 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 (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid?
The CAS number of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid is 436088-91-4.
What is the molecular formula of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid?
The molecular formula of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid is C11H10N2O3S2.
What is the molecular weight of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid?
The molecular weight of (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid is 282.01 g/mol.
Where can I buy (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid?
You can request a quote for (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (6-Acetylamino-benzothiazol-2-ylsulfanyl)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.