VU0497936-1
TL;DR: VU0497936-1 (CAS 899753-33-4) is a chemical compound with molecular formula C20H16N4O6 and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(4-nitrophenyl)-6-oxopyridazin-1-yl]acetamide
Also Known As: VU0497936-1, F2774-2049, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(4-nitrophenyl)-6-oxopyridazin-1-yl]acetamide, N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-(3-(4-nitrophenyl)-6-oxopyridazin-1(6H)-yl)acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(4-nitrophenyl)-6-oxo-1,6-dihydropyridazin-1-yl]acetamide
| Molecular Formula | C20H16N4O6 |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | 2.2284 |
| Topological Polar Surface Area | 125.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.107 |
| Heavy Atoms | 30 |
| Complexity | 1172.6594 |
Chemical Identifiers
| CAS Number | 899753-33-4 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CN3C(=O)C=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
VU0497936-1 (CAS 899753-33-4), with molecular formula C20H16N4O6 and molecular weight 408.11 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(4-nitrophenyl)-6-oxopyridazin-1-yl]acetamide.
Chemical Property Profile of VU0497936-1
Property Insights of VU0497936-1
The XLogP value of 2.2284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0497936-1. The TPSA of 125.59 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0497936-1. Following Lipinski's Rule of Five, VU0497936-1 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 VU0497936-1?
The CAS number of VU0497936-1 is 899753-33-4.
What is the molecular formula of VU0497936-1?
The molecular formula of VU0497936-1 is C20H16N4O6.
What is the molecular weight of VU0497936-1?
The molecular weight of VU0497936-1 is 408.11 g/mol.
Where can I buy VU0497936-1?
You can request a quote for VU0497936-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0497936-1?
Yes, KEHONG BIO provides custom synthesis services for VU0497936-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.