VU0491996-1
TL;DR: VU0491996-1 (CAS 898464-82-9) is a chemical compound with molecular formula C19H19ClN2O4S and molecular weight 406.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methoxyphenyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide
Also Known As: VU0491996-1, AB00680912-01, F2669-0156, N-(5-chloro-2-methoxyphenyl)-2-oxo-1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-triene-7-sulfonamide, N-(5-chloro-2-methoxyphenyl)-3-oxo-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-sulfonamide
| Molecular Formula | C19H19ClN2O4S |
|---|---|
| Molecular Weight | 406.08 g/mol |
| LogP | 3.3748 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.0754 |
| Heavy Atoms | 27 |
| Complexity | 1018.9954 |
Chemical Identifiers
| CAS Number | 898464-82-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC3=C4C(=C2)CCC(=O)N4CCC3 |
Product Overview
VU0491996-1 (CAS 898464-82-9), with molecular formula C19H19ClN2O4S and molecular weight 406.08 g/mol. IUPAC: N-(5-chloro-2-methoxyphenyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide.
Chemical Property Profile of VU0491996-1
Property Insights of VU0491996-1
The XLogP value of 3.3748 indicates that VU0491996-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0491996-1. Following Lipinski's Rule of Five, VU0491996-1 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 VU0491996-1?
The CAS number of VU0491996-1 is 898464-82-9.
What is the molecular formula of VU0491996-1?
The molecular formula of VU0491996-1 is C19H19ClN2O4S.
What is the molecular weight of VU0491996-1?
The molecular weight of VU0491996-1 is 406.08 g/mol.
Where can I buy VU0491996-1?
You can request a quote for VU0491996-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0491996-1?
Yes, KEHONG BIO provides custom synthesis services for VU0491996-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.