VU0616780-1
TL;DR: VU0616780-1 (CAS 843668-88-2) is a chemical compound with molecular formula C19H13NO5 and molecular weight 335.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl]oxyacetonitrile
Also Known As: VU0616780-1, 2-((3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl)oxy)acetonitrile, F3385-1000, 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl]oxyacetonitrile, 2-{[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-yl]oxy}acetonitrile
| Molecular Formula | C19H13NO5 |
|---|---|
| Molecular Weight | 335.08 g/mol |
| LogP | 3.13358 |
| Topological Polar Surface Area | 81.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.07938 |
| Heavy Atoms | 25 |
| Complexity | 1047.8444 |
Chemical Identifiers
| CAS Number | 843668-88-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=COC4=C(C3=O)C=CC(=C4)OCC#N |
Product Overview
VU0616780-1 (CAS 843668-88-2), with molecular formula C19H13NO5 and molecular weight 335.08 g/mol. IUPAC: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl]oxyacetonitrile.
Chemical Property Profile of VU0616780-1
Property Insights of VU0616780-1
The XLogP value of 3.13358 indicates that VU0616780-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.69 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0616780-1. Following Lipinski's Rule of Five, VU0616780-1 has 0 hydrogen bond donor(s) and 6 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 VU0616780-1?
The CAS number of VU0616780-1 is 843668-88-2.
What is the molecular formula of VU0616780-1?
The molecular formula of VU0616780-1 is C19H13NO5.
What is the molecular weight of VU0616780-1?
The molecular weight of VU0616780-1 is 335.08 g/mol.
Where can I buy VU0616780-1?
You can request a quote for VU0616780-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616780-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616780-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.