VU0491945-1
TL;DR: VU0491945-1 (CAS 898419-56-2) is a chemical compound with molecular formula C20H22N2O4S and molecular weight 386.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2-methoxyphenyl)ethyl]-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide
Also Known As: VU0491945-1, N-(2-methoxyphenethyl)-4-oxo-2,4,5,6-tetrahydro-1H-pyrrolo[3,2,1-ij]quinoline-8-sulfonamide, N-[2-(2-methoxyphenyl)ethyl]-11-oxo-1-azatricyclo[6.3.1.0^{4,12}]dodeca-4(12),5,7-triene-6-sulfonamide, N-[2-(2-methoxyphenyl)ethyl]-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide
| Molecular Formula | C20H22N2O4S |
|---|---|
| Molecular Weight | 386.13 g/mol |
| LogP | 2.0515 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.13004 |
| Heavy Atoms | 27 |
| Complexity | 1001.03644 |
Chemical Identifiers
| CAS Number | 898419-56-2 |
|---|---|
| SMILES | COC1=CC=CC=C1CCNS(=O)(=O)C2=CC3=C4C(=C2)CCN4C(=O)CC3 |
Product Overview
VU0491945-1 (CAS 898419-56-2), with molecular formula C20H22N2O4S and molecular weight 386.13 g/mol. IUPAC: N-[2-(2-methoxyphenyl)ethyl]-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide.
Chemical Property Profile of VU0491945-1
Property Insights of VU0491945-1
The XLogP value of 2.0515 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0491945-1. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0491945-1. Following Lipinski's Rule of Five, VU0491945-1 has 1 hydrogen bond donor(s) and 4 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 VU0491945-1?
The CAS number of VU0491945-1 is 898419-56-2.
What is the molecular formula of VU0491945-1?
The molecular formula of VU0491945-1 is C20H22N2O4S.
What is the molecular weight of VU0491945-1?
The molecular weight of VU0491945-1 is 386.13 g/mol.
Where can I buy VU0491945-1?
You can request a quote for VU0491945-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0491945-1?
Yes, KEHONG BIO provides custom synthesis services for VU0491945-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.