A3050/0128804
TL;DR: A3050/0128804 (CAS 433329-36-3) is a chemical compound with molecular formula C25H30N2O7 and molecular weight 470.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: A3050/0128804, cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C25H30N2O7 |
|---|---|
| Molecular Weight | 470.21 g/mol |
| LogP | 4.5429 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.2053 |
| Heavy Atoms | 34 |
| Complexity | 1080.9802 |
Chemical Identifiers
| CAS Number | 433329-36-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])C(=O)OC4CCCCCC4 |
Product Overview
A3050/0128804 (CAS 433329-36-3), with molecular formula C25H30N2O7 and molecular weight 470.21 g/mol. IUPAC: cycloheptyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of A3050/0128804
Property Insights of A3050/0128804
The XLogP value of 4.5429 indicates that A3050/0128804 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A3050/0128804. Following Lipinski's Rule of Five, A3050/0128804 has 2 hydrogen bond donor(s) and 8 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 A3050/0128804?
The CAS number of A3050/0128804 is 433329-36-3.
What is the molecular formula of A3050/0128804?
The molecular formula of A3050/0128804 is C25H30N2O7.
What is the molecular weight of A3050/0128804?
The molecular weight of A3050/0128804 is 470.21 g/mol.
Where can I buy A3050/0128804?
You can request a quote for A3050/0128804 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3050/0128804?
Yes, KEHONG BIO provides custom synthesis services for A3050/0128804 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.