ChemDiv1_007066
TL;DR: ChemDiv1_007066 (CAS 361199-70-4) is a chemical compound with molecular formula C23H28ClN3O5S and molecular weight 493.14 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-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate
Also Known As: ChemDiv1_007066, ethyl 4-(2-(N-(4-chloro-2-methylphenyl)-4-methylphenylsulfonamido)acetyl)piperazine-1-carboxylate, ethyl 4-[2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate, ETHYL 4-{2-[N-(4-CHLORO-2-METHYLPHENYL)4-METHYLBENZENESULFONAMIDO]ACETYL}PIPERAZINE-1-CARBOXYLATE, ethyl 4-{N-(4-chloro-2-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate
| Molecular Formula | C23H28ClN3O5S |
|---|---|
| Molecular Weight | 493.14 g/mol |
| LogP | 3.45284 |
| Topological Polar Surface Area | 87.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.14383 |
| Heavy Atoms | 33 |
| Complexity | 1113.4169 |
Chemical Identifiers
| CAS Number | 361199-70-4 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=C(C=C2)Cl)C)S(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
ChemDiv1_007066 (CAS 361199-70-4), with molecular formula C23H28ClN3O5S and molecular weight 493.14 g/mol. IUPAC: ethyl 4-[2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of ChemDiv1_007066
Property Insights of ChemDiv1_007066
The XLogP value of 3.45284 indicates that ChemDiv1_007066 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007066. Following Lipinski's Rule of Five, ChemDiv1_007066 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 ChemDiv1_007066?
The CAS number of ChemDiv1_007066 is 361199-70-4.
What is the molecular formula of ChemDiv1_007066?
The molecular formula of ChemDiv1_007066 is C23H28ClN3O5S.
What is the molecular weight of ChemDiv1_007066?
The molecular weight of ChemDiv1_007066 is 493.14 g/mol.
Where can I buy ChemDiv1_007066?
You can request a quote for ChemDiv1_007066 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007066?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007066 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.