ChemDiv3_012641
TL;DR: ChemDiv3_012641 (CAS 893286-62-9) is a chemical compound with molecular formula C22H22N4O3S and molecular weight 422.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-N-[2-[2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl]benzamide
Also Known As: ChemDiv3_012641, BRD-K54561505-001-01-9, 2,3-DIMETHOXY-N-{2-[2-(4-METHYLPHENYL)-[1,2,4]TRIAZOLO[3,2-B][1,3]THIAZOL-6-YL]ETHYL}BENZAMIDE, 2,3-Dimethoxy-N-(2-(2-(p-tolyl)thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl)benzamide, 2,3-dimethoxy-N-[2-[2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl]benzamide
| Molecular Formula | C22H22N4O3S |
|---|---|
| Molecular Weight | 422.14 g/mol |
| LogP | 3.75592 |
| Topological Polar Surface Area | 77.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.14127 |
| Heavy Atoms | 30 |
| Complexity | 1181.0413 |
Chemical Identifiers
| CAS Number | 893286-62-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN3C(=CSC3=N2)CCNC(=O)C4=C(C(=CC=C4)OC)OC |
Product Overview
ChemDiv3_012641 (CAS 893286-62-9), with molecular formula C22H22N4O3S and molecular weight 422.14 g/mol. IUPAC: 2,3-dimethoxy-N-[2-[2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl]benzamide.
Chemical Property Profile of ChemDiv3_012641
Property Insights of ChemDiv3_012641
The XLogP value of 3.75592 indicates that ChemDiv3_012641 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012641. Following Lipinski's Rule of Five, ChemDiv3_012641 has 1 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 ChemDiv3_012641?
The CAS number of ChemDiv3_012641 is 893286-62-9.
What is the molecular formula of ChemDiv3_012641?
The molecular formula of ChemDiv3_012641 is C22H22N4O3S.
What is the molecular weight of ChemDiv3_012641?
The molecular weight of ChemDiv3_012641 is 422.14 g/mol.
Where can I buy ChemDiv3_012641?
You can request a quote for ChemDiv3_012641 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012641?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.