Bionet1_002507
TL;DR: Bionet1_002507 (CAS 321433-74-3) is a chemical compound with molecular formula C11H12ClF3N4O2S and molecular weight 356.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]carbamothioylamino]acetate
Also Known As: Bionet1_002507, ethyl 2-[({2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]hydrazino}carbothioyl)amino]acetate, 1K-027, ethyl 2-[({[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}carbamothioyl)amino]acetate, 1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(ethoxycarbonylmethyl)-3-thiosemicarbazide
| Molecular Formula | C11H12ClF3N4O2S |
|---|---|
| Molecular Weight | 356.03 g/mol |
| LogP | 2.1079 |
| Topological Polar Surface Area | 75.28 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.03217 |
| Heavy Atoms | 22 |
| Complexity | 556.62897 |
Chemical Identifiers
| CAS Number | 321433-74-3 |
|---|---|
| SMILES | CCOC(=O)CNC(=S)NNC1=C(C=C(C=N1)C(F)(F)F)Cl |
Product Overview
Bionet1_002507 (CAS 321433-74-3), with molecular formula C11H12ClF3N4O2S and molecular weight 356.03 g/mol. IUPAC: ethyl 2-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]carbamothioylamino]acetate.
Chemical Property Profile of Bionet1_002507
Property Insights of Bionet1_002507
The XLogP value of 2.1079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002507. The TPSA of 75.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002507. Following Lipinski's Rule of Five, Bionet1_002507 has 3 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 Bionet1_002507?
The CAS number of Bionet1_002507 is 321433-74-3.
What is the molecular formula of Bionet1_002507?
The molecular formula of Bionet1_002507 is C11H12ClF3N4O2S.
What is the molecular weight of Bionet1_002507?
The molecular weight of Bionet1_002507 is 356.03 g/mol.
Where can I buy Bionet1_002507?
You can request a quote for Bionet1_002507 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002507?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002507 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.