VU0491953-1
TL;DR: VU0491953-1 (CAS 898463-23-5) is a chemical compound with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)benzamide
Also Known As: VU0491953-1, 3,4,5-trimethoxy-N-{2-oxo-1-azatricyclo[6.3.1.0^{4,12}]dodeca-4,6,8(12)-trien-6-yl}benzamide, 3,4,5-trimethoxy-N-(2-oxo-2,4,5,6-tetrahydro-1H-pyrrolo[3,2,1-ij]quinolin-8-yl)benzamide, 3,4,5-trimethoxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)benzamide
| Molecular Formula | C21H22N2O5 |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.15286 |
| Heavy Atoms | 28 |
| Complexity | 944.50366 |
Chemical Identifiers
| CAS Number | 898463-23-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC3=C4C(=C2)CC(=O)N4CCC3 |
Product Overview
VU0491953-1 (CAS 898463-23-5), with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol. IUPAC: 3,4,5-trimethoxy-N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)benzamide.
Chemical Property Profile of VU0491953-1
Property Insights of VU0491953-1
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0491953-1. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0491953-1. Following Lipinski's Rule of Five, VU0491953-1 has 1 hydrogen bond donor(s) and 5 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 VU0491953-1?
The CAS number of VU0491953-1 is 898463-23-5.
What is the molecular formula of VU0491953-1?
The molecular formula of VU0491953-1 is C21H22N2O5.
What is the molecular weight of VU0491953-1?
The molecular weight of VU0491953-1 is 382.15 g/mol.
Where can I buy VU0491953-1?
You can request a quote for VU0491953-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0491953-1?
Yes, KEHONG BIO provides custom synthesis services for VU0491953-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.