BAS 03152559
TL;DR: BAS 03152559 (CAS 428504-52-3) is a chemical compound with molecular formula C22H29N3O5S and molecular weight 447.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[4-[(4-ethoxy-3-methoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]acetamide
Also Known As: BAS 03152559, N-[4-[4-[(4-ethoxy-3-methoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]acetamide, N-{4-[4-(4-Ethoxy-3-methoxy-benzyl)-piperazine-1-sulfonyl]-phenyl}-acetamide, N-(4-{[4-(4-ethoxy-3-methoxybenzyl)piperazin-1-yl]sulfonyl}phenyl)acetamide, N-[4-[4-(4-ethoxy-3-methoxy-benzyl)piperazino]sulfonylphenyl]acetamide;oxalic acid
| Molecular Formula | C22H29N3O5S |
|---|---|
| Molecular Weight | 447.18 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 96.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 447.1828 |
| Heavy Atoms | 31 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 428504-52-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)OC |
| InChIKey | SSLWGDKUWZMHJB-UHFFFAOYSA-N |
Product Overview
BAS 03152559 (CAS 428504-52-3), with molecular formula C22H29N3O5S and molecular weight 447.18 g/mol. IUPAC: N-[4-[4-[(4-ethoxy-3-methoxyphenyl)methyl]piperazin-1-yl]sulfonylphenyl]acetamide.
Chemical Property Profile of BAS 03152559
Property Insights of BAS 03152559
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03152559. The TPSA of 96.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03152559. Following Lipinski's Rule of Five, BAS 03152559 has 1 hydrogen bond donor(s) and 7 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 03152559?
The CAS number of BAS 03152559 is 428504-52-3.
What is the molecular formula of BAS 03152559?
The molecular formula of BAS 03152559 is C22H29N3O5S.
What is the molecular weight of BAS 03152559?
The molecular weight of BAS 03152559 is 447.18 g/mol.
Where can I buy BAS 03152559?
You can request a quote for BAS 03152559 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03152559?
Yes, KEHONG BIO provides custom synthesis services for BAS 03152559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.