![[2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate structure](/static/products/4386/438602-58-5.webp)
[2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate
TL;DR: [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate (CAS 438602-58-5) is a chemical compound with molecular formula C12H8BrN3O5S and molecular weight 384.9368 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate
Also Known As: [2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate, (5-bromo-1,3-thiazol-2-yl)carbamoylmethyl 3-nitrobenzoate, 2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl 3-nitrobenzoate
Technical Specifications
| Molecular Formula | C12H8BrN3O5S |
| Molecular Weight | 384.9368 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.9368 Da |
| Heavy Atoms | 22 |
| Complexity | 447.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=NC=C(S2)Br |
| InChIKey | MTTITHTVQCJRPW-UHFFFAOYSA-N |
Product Description
Applications: [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
[2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate (CAS 438602-58-5) is a fine chemical with the molecular formula C12H8BrN3O5S and a molecular weight of 384.94 g/mol. Synonyms include SR-01000067699-1 and [2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate
Property Insights of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate. The TPSA of 142.0 Ų indicates high polarity, suggesting [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate 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
What is the CAS number of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate?
The CAS number of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate is 438602-58-5.
What is the molecular formula of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate?
The molecular formula of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate is C12H8BrN3O5S.
What is the molecular weight of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate?
The molecular weight of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate is 384.9368 g/mol.
What are the applications of [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate?
[2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate?
You can request a quote for [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate?
Yes, CoreyChem provides custom synthesis services for [2-[(5-Bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.