Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate
TL;DR: Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate (CAS 134949-40-9) is a chemical compound with molecular formula C11H10N2O3S and molecular weight 250.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-acetamido-1,3-benzothiazole-6-carboxylate
Also Known As: 4kz0, IFLab1_005515, 2-acetamido-6-carbomethoxybenzthiazole, IDI1_010918, methyl 2-acetamido-1,3-benzothiazole-6-carboxylate
| Molecular Formula | C11H10N2O3S |
|---|---|
| Molecular Weight | 250.04 g/mol |
| LogP | 2.0413 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.04121 |
| Heavy Atoms | 17 |
| Complexity | 591.4141 |
Chemical Identifiers
| CAS Number | 134949-40-9 |
|---|---|
| SMILES | CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OC |
Product Overview
Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate (CAS 134949-40-9), with molecular formula C11H10N2O3S and molecular weight 250.04 g/mol. IUPAC: methyl 2-acetamido-1,3-benzothiazole-6-carboxylate.
Chemical Property Profile of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate
Property Insights of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate
The XLogP value of 2.0413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate. Following Lipinski's Rule of Five, Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate has 1 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 Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate?
The CAS number of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate is 134949-40-9.
What is the molecular formula of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate?
The molecular formula of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate is C11H10N2O3S.
What is the molecular weight of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate?
The molecular weight of Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate is 250.04 g/mol.
Where can I buy Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate?
You can request a quote for Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(Acetylamino)-1,3-Benzothiazole-6-Carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.