J1.127.649K
TL;DR: J1.127.649K (CAS 233767-36-7) is a chemical compound with molecular formula C17H11ClN4O2S and molecular weight 370.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-chlorophenoxy)methyl]-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Also Known As: J1.127.649K, 7-[(4-chlorophenoxy)methyl]-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one, 7-[(4-chlorophenoxy)methyl]-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one, AO-365/43368544, 7-((4-chlorophenoxy)methyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
| Molecular Formula | C17H11ClN4O2S |
|---|---|
| Molecular Weight | 370.03 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.0291 |
| Heavy Atoms | 25 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 233767-36-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C3N(C2=O)N=C(S3)COC4=CC=C(C=C4)Cl |
| InChIKey | DDKCLOMCVBAOSO-UHFFFAOYSA-N |
Product Overview
J1.127.649K (CAS 233767-36-7), with molecular formula C17H11ClN4O2S and molecular weight 370.03 g/mol. IUPAC: 7-[(4-chlorophenoxy)methyl]-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one.
Chemical Property Profile of J1.127.649K
Property Insights of J1.127.649K
The XLogP value of 4.3 indicates that J1.127.649K is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.127.649K. Following Lipinski's Rule of Five, J1.127.649K has 0 hydrogen bond donor(s) and 6 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 J1.127.649K?
The CAS number of J1.127.649K is 233767-36-7.
What is the molecular formula of J1.127.649K?
The molecular formula of J1.127.649K is C17H11ClN4O2S.
What is the molecular weight of J1.127.649K?
The molecular weight of J1.127.649K is 370.03 g/mol.
Where can I buy J1.127.649K?
You can request a quote for J1.127.649K directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.127.649K?
Yes, KEHONG BIO provides custom synthesis services for J1.127.649K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.