T0509-4626
TL;DR: T0509-4626 (CAS 6579-98-2) is a chemical compound with molecular formula C24H28N4O5 and molecular weight 452.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3,7,7-trimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-4,6,8,9-tetrahydropyrazolo[5,4-b]quinolin-5-one
Also Known As: T0509-4626, 1-tert-butyl-3,7,7-trimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-2,4,6,8-tetrahydropyrazolo[3,4-b]quinolin-5-one, 1-Tert-butyl-3,7,7-trimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-4,6,8,9-tetrahydropyrazolo[3,4-b]quinolin-5-one, 1-tert-Butyl-3,7,7-trimethyl-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,2,4,6,7,8-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
| Molecular Formula | C24H28N4O5 |
|---|---|
| Molecular Weight | 452.21 g/mol |
| LogP | 4.78402 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 452.20596 |
| Heavy Atoms | 33 |
| Complexity | 1248.5215 |
Chemical Identifiers
| CAS Number | 6579-98-2 |
|---|---|
| SMILES | CC1=NN(C2=C1C(C3=C(N2)CC(CC3=O)(C)C)C4=CC5=C(C=C4[N+](=O)[O-])OCO5)C(C)(C)C |
Product Overview
T0509-4626 (CAS 6579-98-2), with molecular formula C24H28N4O5 and molecular weight 452.21 g/mol. IUPAC: 1-tert-butyl-3,7,7-trimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-4,6,8,9-tetrahydropyrazolo[5,4-b]quinolin-5-one.
Chemical Property Profile of T0509-4626
Property Insights of T0509-4626
The XLogP value of 4.78402 indicates that T0509-4626 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.52 Ų falls within the moderate polarity range, balancing permeability and solubility for T0509-4626. Following Lipinski's Rule of Five, T0509-4626 has 1 hydrogen bond donor(s) and 7 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 T0509-4626?
The CAS number of T0509-4626 is 6579-98-2.
What is the molecular formula of T0509-4626?
The molecular formula of T0509-4626 is C24H28N4O5.
What is the molecular weight of T0509-4626?
The molecular weight of T0509-4626 is 452.21 g/mol.
Where can I buy T0509-4626?
You can request a quote for T0509-4626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for T0509-4626?
Yes, KEHONG BIO provides custom synthesis services for T0509-4626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.