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Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate
TL;DR: Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate (CAS 681168-75-2) is a chemical compound with molecular formula C14H11N3O3S2 and molecular weight 333.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1,3-benzothiazole-6-carbonylamino)-1,3-thiazole-4-carboxylate
Also Known As: ethyl 2-(1,3-benzothiazole-6-amido)-1,3-thiazole-4-carboxylate, ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate, F0537-0304, ethyl 2-(1,3-benzothiazole-6-carbonylamino)-1,3-thiazole-4-carboxylate
| Molecular Formula | C14H11N3O3S2 |
|---|---|
| Molecular Weight | 333.02 g/mol |
| LogP | 3.1818 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.02417 |
| Heavy Atoms | 22 |
| Complexity | 840.60065 |
Chemical Identifiers
| CAS Number | 681168-75-2 |
|---|---|
| SMILES | CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC3=C(C=C2)N=CS3 |
Product Overview
Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate (CAS 681168-75-2), with molecular formula C14H11N3O3S2 and molecular weight 333.02 g/mol. IUPAC: ethyl 2-(1,3-benzothiazole-6-carbonylamino)-1,3-thiazole-4-carboxylate.
Chemical Property Profile of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate
Property Insights of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate
The XLogP value of 3.1818 indicates that Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate has 1 hydrogen bond donor(s) and 7 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 Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate?
The CAS number of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate is 681168-75-2.
What is the molecular formula of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate?
The molecular formula of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate is C14H11N3O3S2.
What is the molecular weight of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate?
The molecular weight of Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate is 333.02 g/mol.
Where can I buy Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate?
You can request a quote for Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(benzo[d]thiazole-6-carboxamido)thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.