Bionet1_004752
TL;DR: Bionet1_004752 (CAS 439111-30-5) is a chemical compound with molecular formula C15H17N3O5S2 and molecular weight 383.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(methanesulfonamido)phenoxy]-2-methylsulfanylpyrimidine-5-carboxylate
Also Known As: Bionet1_004752, 6R-1173, ethyl 2-(methylsulfanyl)-4-{3-[(methylsulfonyl)amino]phenoxy}-5-pyrimidinecarboxylate, ethyl 4-[3-(methanesulfonamido)phenoxy]-2-methylsulfanylpyrimidine-5-carboxylate, ethyl 4-(3-methanesulfonamidophenoxy)-2-(methylsulfanyl)pyrimidine-5-carboxylate
| Molecular Formula | C15H17N3O5S2 |
|---|---|
| Molecular Weight | 383.06 g/mol |
| LogP | 2.539 |
| Topological Polar Surface Area | 107.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.06097 |
| Heavy Atoms | 25 |
| Complexity | 871.2206 |
Chemical Identifiers
| CAS Number | 439111-30-5 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1OC2=CC=CC(=C2)NS(=O)(=O)C)SC |
Product Overview
Bionet1_004752 (CAS 439111-30-5), with molecular formula C15H17N3O5S2 and molecular weight 383.06 g/mol. IUPAC: ethyl 4-[3-(methanesulfonamido)phenoxy]-2-methylsulfanylpyrimidine-5-carboxylate.
Chemical Property Profile of Bionet1_004752
Property Insights of Bionet1_004752
The XLogP value of 2.539 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_004752. The TPSA of 107.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004752. Following Lipinski's Rule of Five, Bionet1_004752 has 1 hydrogen bond donor(s) and 8 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 Bionet1_004752?
The CAS number of Bionet1_004752 is 439111-30-5.
What is the molecular formula of Bionet1_004752?
The molecular formula of Bionet1_004752 is C15H17N3O5S2.
What is the molecular weight of Bionet1_004752?
The molecular weight of Bionet1_004752 is 383.06 g/mol.
Where can I buy Bionet1_004752?
You can request a quote for Bionet1_004752 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004752?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004752 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.