BAS 01022602
TL;DR: BAS 01022602 (CAS 299962-63-3) is a chemical compound with molecular formula C19H25BrN2O4S and molecular weight 456.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetamido-6-bromo-7-[2-(diethylamino)ethoxy]-1-benzothiophene-3-carboxylate
Also Known As: BAS 01022602, A1747/0074134, ethyl 2-acetamido-6-bromo-7-(2-(diethylamino)ethoxy)benzo[b]thiophene-3-carboxylate, ETHYL 6-BROMO-7-[2-(DIETHYLAMINO)ETHOXY]-2-ACETAMIDO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-(acetylamino)-6-bromo-7-[2-(diethylamino)ethoxy]-1-benzothiophene-3-carboxylate
| Molecular Formula | C19H25BrN2O4S |
|---|---|
| Molecular Weight | 456.07 g/mol |
| LogP | 4.5195 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 456.07184 |
| Heavy Atoms | 27 |
| Complexity | 817.6328 |
Chemical Identifiers
| CAS Number | 299962-63-3 |
|---|---|
| SMILES | CCN(CC)CCOC1=C(C=CC2=C1SC(=C2C(=O)OCC)NC(=O)C)Br |
Product Overview
BAS 01022602 (CAS 299962-63-3), with molecular formula C19H25BrN2O4S and molecular weight 456.07 g/mol. IUPAC: ethyl 2-acetamido-6-bromo-7-[2-(diethylamino)ethoxy]-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 01022602
Property Insights of BAS 01022602
The XLogP value of 4.5195 indicates that BAS 01022602 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01022602. Following Lipinski's Rule of Five, BAS 01022602 has 1 hydrogen bond donor(s) and 6 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 BAS 01022602?
The CAS number of BAS 01022602 is 299962-63-3.
What is the molecular formula of BAS 01022602?
The molecular formula of BAS 01022602 is C19H25BrN2O4S.
What is the molecular weight of BAS 01022602?
The molecular weight of BAS 01022602 is 456.07 g/mol.
Where can I buy BAS 01022602?
You can request a quote for BAS 01022602 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01022602?
Yes, KEHONG BIO provides custom synthesis services for BAS 01022602 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.