8T-0012
TL;DR: 8T-0012 (CAS 866136-92-7) is a chemical compound with molecular formula C22H15F5N4O3 and molecular weight 478.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentafluorophenyl) 4-[(4-methoxyphenyl)methylamino]-1-methylpyrazolo[3,4-b]pyridine-5-carboxylate
Also Known As: 8T-0012, 2,3,4,5,6-pentafluorophenyl 4-[(4-methoxybenzyl)amino]-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate, (2,3,4,5,6-pentafluorophenyl) 4-[(4-methoxyphenyl)methylamino]-1-methylpyrazolo[3,4-b]pyridine-5-carboxylate, 2,3,4,5,6-pentafluorophenyl 4-{[(4-methoxyphenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate, 2,3,4,5,6-pentafluorophenyl4-{[(4-methoxyphenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
| Molecular Formula | C22H15F5N4O3 |
|---|---|
| Molecular Weight | 478.11 g/mol |
| LogP | 4.5037 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.10645 |
| Heavy Atoms | 34 |
| Complexity | 1377.4252 |
Chemical Identifiers
| CAS Number | 866136-92-7 |
|---|---|
| SMILES | CN1C2=NC=C(C(=C2C=N1)NCC3=CC=C(C=C3)OC)C(=O)OC4=C(C(=C(C(=C4F)F)F)F)F |
Product Overview
8T-0012 (CAS 866136-92-7), with molecular formula C22H15F5N4O3 and molecular weight 478.11 g/mol. IUPAC: (2,3,4,5,6-pentafluorophenyl) 4-[(4-methoxyphenyl)methylamino]-1-methylpyrazolo[3,4-b]pyridine-5-carboxylate.
Chemical Property Profile of 8T-0012
Property Insights of 8T-0012
The XLogP value of 4.5037 indicates that 8T-0012 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 8T-0012. Following Lipinski's Rule of Five, 8T-0012 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 8T-0012?
The CAS number of 8T-0012 is 866136-92-7.
What is the molecular formula of 8T-0012?
The molecular formula of 8T-0012 is C22H15F5N4O3.
What is the molecular weight of 8T-0012?
The molecular weight of 8T-0012 is 478.11 g/mol.
Where can I buy 8T-0012?
You can request a quote for 8T-0012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8T-0012?
Yes, KEHONG BIO provides custom synthesis services for 8T-0012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.