VU0616871-1
TL;DR: VU0616871-1 (CAS 879449-55-5) is a chemical compound with molecular formula C20H20N4O6 and molecular weight 412.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[5-[4-(2-hydrazinyl-2-oxoethoxy)-2-hydroxyphenyl]-1H-pyrazol-4-yl]oxy]benzoate
Also Known As: VU0616871-1, ETHYL 4-[(3-{4-[(HYDRAZINECARBONYL)METHOXY]-2-HYDROXYPHENYL}-1H-PYRAZOL-4-YL)OXY]BENZOATE, ethyl 4-[[(3E)-3-[4-(2-hydrazinyl-2-oxoethoxy)-6-oxocyclohexa-2,4-dien-1-ylidene]-1,2-dihydropyrazol-4-yl]oxy]benzoate, ethyl 4-((3-(4-(2-hydrazinyl-2-oxoethoxy)-2-hydroxyphenyl)-1H-pyrazol-4-yl)oxy)benzoate, ethyl 4-{3-[2-hydroxy-4-(???methoxy)phenyl]pyrazol-4-yloxy}benzoate
| Molecular Formula | C20H20N4O6 |
|---|---|
| Molecular Weight | 412.14 g/mol |
| LogP | 2.12 |
| Topological Polar Surface Area | 148.79 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.13828 |
| Heavy Atoms | 30 |
| Complexity | 1032.0309 |
Chemical Identifiers
| CAS Number | 879449-55-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)OC2=C(NN=C2)C3=C(C=C(C=C3)OCC(=O)NN)O |
Product Overview
VU0616871-1 (CAS 879449-55-5), with molecular formula C20H20N4O6 and molecular weight 412.14 g/mol. IUPAC: ethyl 4-[[5-[4-(2-hydrazinyl-2-oxoethoxy)-2-hydroxyphenyl]-1H-pyrazol-4-yl]oxy]benzoate.
Chemical Property Profile of VU0616871-1
Property Insights of VU0616871-1
The XLogP value of 2.12 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0616871-1. The TPSA of 148.79 Ų indicates high polarity, suggesting VU0616871-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, VU0616871-1 has 4 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 VU0616871-1?
The CAS number of VU0616871-1 is 879449-55-5.
What is the molecular formula of VU0616871-1?
The molecular formula of VU0616871-1 is C20H20N4O6.
What is the molecular weight of VU0616871-1?
The molecular weight of VU0616871-1 is 412.14 g/mol.
Where can I buy VU0616871-1?
You can request a quote for VU0616871-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616871-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616871-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.