Cgs 22996
TL;DR: Cgs 22996 (CAS 124027-46-9) is a chemical compound with molecular formula C16H20N6O and molecular weight 312.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(4-methylpiperazin-1-yl)-6-oxido-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepin-6-ium
Also Known As: Cgs 22996, 2-methyl-5-(4-methylpiperazin-1-yl)-6-oxido-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepin-6-ium, 2-Methyl-5-(4-methyl-4-N-oxide-1-piperazinyl)-11H-(1,2,4)triazolo(1,5-C)(1,3)benzodiazepine, 11H-(1,2,4)Triazolo(1,5-c)(1,3)benzodiazepine, 2-methyl-5-(4-methyl-1-piperazinyl)-, N-oxide, 2-Methyl-5-(4-methylpiperazin-1-yl)-6-oxo-11H-6lambda~5~-[1,2,4]triazolo[1,5-c][1,3]benzodiazepine
| Molecular Formula | C16H20N6O |
|---|---|
| Molecular Weight | 312.17 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 65.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.16986 |
| Heavy Atoms | 23 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 124027-46-9 |
|---|---|
| SMILES | CC1=NN2C(=N1)CC3=CC=CC=C3[N+](=C2N4CCN(CC4)C)[O-] |
| InChIKey | WOKXTQDTAUERAK-UHFFFAOYSA-N |
Product Overview
Cgs 22996 (CAS 124027-46-9), with molecular formula C16H20N6O and molecular weight 312.17 g/mol. IUPAC: 2-methyl-5-(4-methylpiperazin-1-yl)-6-oxido-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepin-6-ium.
Chemical Property Profile of Cgs 22996
Property Insights of Cgs 22996
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cgs 22996. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Cgs 22996. Following Lipinski's Rule of Five, Cgs 22996 has 0 hydrogen bond donor(s) and 4 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 Cgs 22996?
The CAS number of Cgs 22996 is 124027-46-9.
What is the molecular formula of Cgs 22996?
The molecular formula of Cgs 22996 is C16H20N6O.
What is the molecular weight of Cgs 22996?
The molecular weight of Cgs 22996 is 312.17 g/mol.
Where can I buy Cgs 22996?
You can request a quote for Cgs 22996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cgs 22996?
Yes, KEHONG BIO provides custom synthesis services for Cgs 22996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.