GR 99062
TL;DR: GR 99062 (CAS 178979-81-2) is a chemical compound with molecular formula C16H20N6 and molecular weight 296.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,8-dimethyl-3-(4-methylpiperazin-1-yl)-[1,2,4]triazino[5,6-b]indole
Also Known As: 5,8-dimethyl-3-(4-methylpiperazin-1-yl)-[1,2,4]triazino[5,6-b]indole, 5H-1,2,4-Triazino[5,6-b]indole, 5,8-dimethyl-3-(4-methyl-1-piperazinyl)-, 5H-1,2,4-Triazino(5,6-b)indole, 5,8-dimethyl-3-(4-methyl-1-piperazinyl)-, 5H-1,2,4-Triazino[5,6-b]indole,5,8-dimethyl-3-(4-methyl-1-piperazinyl)-, 5,8-Dimethyl-3-(4-methyl-1-piperazinyl)-5H-1,2,4-triazino(5,6-b)indole
| Molecular Formula | C16H20N6 |
|---|---|
| Molecular Weight | 296.17 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.17496 |
| Heavy Atoms | 22 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 178979-81-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)N4CCN(CC4)C)C |
| InChIKey | YMKXKOOZXSGBGK-UHFFFAOYSA-N |
Product Overview
GR 99062 (CAS 178979-81-2), with molecular formula C16H20N6 and molecular weight 296.17 g/mol. IUPAC: 5,8-dimethyl-3-(4-methylpiperazin-1-yl)-[1,2,4]triazino[5,6-b]indole.
Chemical Property Profile of GR 99062
Property Insights of GR 99062
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for GR 99062. With a topological polar surface area (TPSA) of 50.1 Ų, GR 99062 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, GR 99062 has 0 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 GR 99062?
The CAS number of GR 99062 is 178979-81-2.
What is the molecular formula of GR 99062?
The molecular formula of GR 99062 is C16H20N6.
What is the molecular weight of GR 99062?
The molecular weight of GR 99062 is 296.17 g/mol.
Where can I buy GR 99062?
You can request a quote for GR 99062 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GR 99062?
Yes, KEHONG BIO provides custom synthesis services for GR 99062 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.