Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate
TL;DR: Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate (CAS 355384-35-9) is a chemical compound with molecular formula C10H9BrN2O2S and molecular weight 299.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(6-bromo-1,3-benzothiazol-2-yl)carbamate
Also Known As: Ethyl N-(6-bromo-2-benzothiazolyl)carbamate, N-(6-bromobenzothiazol-2-yl)ethoxycarboxamide, ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate, ethyl N-(6-bromo-1,3-benzothiazol-2-yl)carbamate
| Molecular Formula | C10H9BrN2O2S |
|---|---|
| Molecular Weight | 299.96 g/mol |
| LogP | 3.6272 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.95682 |
| Heavy Atoms | 16 |
| Complexity | 526.5134 |
Chemical Identifiers
| CAS Number | 355384-35-9 |
|---|---|
| SMILES | CCOC(=O)NC1=NC2=C(S1)C=C(C=C2)Br |
Product Overview
Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate (CAS 355384-35-9), with molecular formula C10H9BrN2O2S and molecular weight 299.96 g/mol. IUPAC: ethyl N-(6-bromo-1,3-benzothiazol-2-yl)carbamate.
Chemical Property Profile of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate
Property Insights of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate
The XLogP value of 3.6272 indicates that Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate has 1 hydrogen bond donor(s) and 4 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 (6-bromo-1,3-benzothiazol-2-yl)carbamate?
The CAS number of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate is 355384-35-9.
What is the molecular formula of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate?
The molecular formula of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate is C10H9BrN2O2S.
What is the molecular weight of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate?
The molecular weight of Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate is 299.96 g/mol.
Where can I buy Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate?
You can request a quote for Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (6-bromo-1,3-benzothiazol-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.