BAS 02806169
TL;DR: BAS 02806169 (CAS 335391-70-3) is a chemical compound with molecular formula C17H24ClN3O5S and molecular weight 417.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(4-chloro-2-methyl-N-methylsulfonylanilino)acetyl]piperazine-1-carboxylate
Also Known As: BAS 02806169, ethyl 4-(2-(N-(4-chloro-2-methylphenyl)methylsulfonamido)acetyl)piperazine-1-carboxylate, ethyl 4-[N-(4-chloro-2-methylphenyl)-N-(methylsulfonyl)glycyl]piperazine-1-carboxylate, ethyl 4-{2-[(4-chloro-2-methylphenyl)(methylsulfonyl)amino]acetyl}piperazineca rboxylate
| Molecular Formula | C17H24ClN3O5S |
|---|---|
| Molecular Weight | 417.11 g/mol |
| LogP | 1.71512 |
| Topological Polar Surface Area | 87.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.11252 |
| Heavy Atoms | 27 |
| Complexity | 806.7869 |
Chemical Identifiers
| CAS Number | 335391-70-3 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=C(C=C2)Cl)C)S(=O)(=O)C |
Product Overview
BAS 02806169 (CAS 335391-70-3), with molecular formula C17H24ClN3O5S and molecular weight 417.11 g/mol. IUPAC: ethyl 4-[2-(4-chloro-2-methyl-N-methylsulfonylanilino)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of BAS 02806169
Property Insights of BAS 02806169
The XLogP value of 1.71512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02806169. The TPSA of 87.23 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02806169. Following Lipinski's Rule of Five, BAS 02806169 has 0 hydrogen bond donor(s) and 5 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 02806169?
The CAS number of BAS 02806169 is 335391-70-3.
What is the molecular formula of BAS 02806169?
The molecular formula of BAS 02806169 is C17H24ClN3O5S.
What is the molecular weight of BAS 02806169?
The molecular weight of BAS 02806169 is 417.11 g/mol.
Where can I buy BAS 02806169?
You can request a quote for BAS 02806169 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02806169?
Yes, KEHONG BIO provides custom synthesis services for BAS 02806169 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.