[(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid
TL;DR: [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid (CAS 332383-09-2) is a chemical compound with molecular formula C12H12N2O3S2 and molecular weight 296.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylacetic acid
Also Known As: [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid, BAS 01521826, [(6-Methyl-benzothiazol-2-ylcarbamoyl)-methylsulfanyl]-acetic acid, 2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylacetic acid, 2-((2-((6-Methylbenzo[d]thiazol-2-yl)amino)-2-oxoethyl)thio)acetic acid
| Molecular Formula | C12H12N2O3S2 |
|---|---|
| Molecular Weight | 296.03 g/mol |
| LogP | 2.36102 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.02893 |
| Heavy Atoms | 19 |
| Complexity | 624.46204 |
Chemical Identifiers
| CAS Number | 332383-09-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC(=O)O |
Product Overview
[(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid (CAS 332383-09-2), with molecular formula C12H12N2O3S2 and molecular weight 296.03 g/mol. IUPAC: 2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylacetic acid.
Chemical Property Profile of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid
Property Insights of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid
The XLogP value of 2.36102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid. Following Lipinski's Rule of Five, [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid has 2 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 [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid?
The CAS number of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid is 332383-09-2.
What is the molecular formula of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid?
The molecular formula of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid is C12H12N2O3S2.
What is the molecular weight of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid?
The molecular weight of [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid is 296.03 g/mol.
Where can I buy [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid?
You can request a quote for [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-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-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(6-methyl-benzothiazol-2-ylcarbamoyl)-methyl-sulfanyl]-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.