BAS 00837708
TL;DR: BAS 00837708 (CAS 301305-00-0) is a chemical compound with molecular formula C19H19Cl2NO4S and molecular weight 427.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(2,5-dichlorophenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 00837708, ethyl 2-{[(2,5-dichlorophenoxy)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-(2,5-dichlorophenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[2-(2,5-dichlorophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(2-(2,5-dichlorophenoxy)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C19H19Cl2NO4S |
|---|---|
| Molecular Weight | 427.04 g/mol |
| LogP | 5.1279 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.0412 |
| Heavy Atoms | 27 |
| Complexity | 865.6348 |
Chemical Identifiers
| CAS Number | 301305-00-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=C(C=CC(=C3)Cl)Cl |
Product Overview
BAS 00837708 (CAS 301305-00-0), with molecular formula C19H19Cl2NO4S and molecular weight 427.04 g/mol. IUPAC: ethyl 2-[[2-(2,5-dichlorophenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 00837708
Property Insights of BAS 00837708
The XLogP value of 5.1279 indicates that BAS 00837708 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00837708. Following Lipinski's Rule of Five, BAS 00837708 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00837708?
The CAS number of BAS 00837708 is 301305-00-0.
What is the molecular formula of BAS 00837708?
The molecular formula of BAS 00837708 is C19H19Cl2NO4S.
What is the molecular weight of BAS 00837708?
The molecular weight of BAS 00837708 is 427.04 g/mol.
Where can I buy BAS 00837708?
You can request a quote for BAS 00837708 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00837708?
Yes, KEHONG BIO provides custom synthesis services for BAS 00837708 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.