VU0610331-1
TL;DR: VU0610331-1 (CAS 825599-89-1) is a chemical compound with molecular formula C22H18F3N3O6 and molecular weight 477.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-6-nitro-3-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]chromen-2-one
Also Known As: VU0610331-1, F3318-0158, 8-methoxy-6-nitro-3-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]chromen-2-one, 8-methoxy-6-nitro-3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-2H-chromen-2-one, 8-methoxy-6-nitro-3-(4-(3-(trifluoromethyl)phenyl)piperazine-1-carbonyl)-2H-chromen-2-one
| Molecular Formula | C22H18F3N3O6 |
|---|---|
| Molecular Weight | 477.11 g/mol |
| LogP | 3.691 |
| Topological Polar Surface Area | 106.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 477.11478 |
| Heavy Atoms | 34 |
| Complexity | 1329.6901 |
Chemical Identifiers
| CAS Number | 825599-89-1 |
|---|---|
| SMILES | COC1=C2C(=CC(=C1)[N+](=O)[O-])C=C(C(=O)O2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
VU0610331-1 (CAS 825599-89-1), with molecular formula C22H18F3N3O6 and molecular weight 477.11 g/mol. IUPAC: 8-methoxy-6-nitro-3-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]chromen-2-one.
Chemical Property Profile of VU0610331-1
Property Insights of VU0610331-1
The XLogP value of 3.691 indicates that VU0610331-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.13 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0610331-1. Following Lipinski's Rule of Five, VU0610331-1 has 0 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 VU0610331-1?
The CAS number of VU0610331-1 is 825599-89-1.
What is the molecular formula of VU0610331-1?
The molecular formula of VU0610331-1 is C22H18F3N3O6.
What is the molecular weight of VU0610331-1?
The molecular weight of VU0610331-1 is 477.11 g/mol.
Where can I buy VU0610331-1?
You can request a quote for VU0610331-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0610331-1?
Yes, KEHONG BIO provides custom synthesis services for VU0610331-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.