VU0491976-1
TL;DR: VU0491976-1 (CAS 896375-44-3) is a chemical compound with molecular formula C20H22N2O3S and molecular weight 370.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methylphenyl)methyl]-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide
Also Known As: VU0491976-1, BRD-K89312987-001-01-3, F2669-0014, N-[(4-methylphenyl)methyl]-2-oxo-1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-triene-7-sulfonamide, N-(4-methylbenzyl)-3-oxo-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-sulfonamide
| Molecular Formula | C20H22N2O3S |
|---|---|
| Molecular Weight | 370.14 g/mol |
| LogP | 2.69892 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.1351 |
| Heavy Atoms | 26 |
| Complexity | 948.04596 |
Chemical Identifiers
| CAS Number | 896375-44-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNS(=O)(=O)C2=CC3=C4C(=C2)CCC(=O)N4CCC3 |
Product Overview
VU0491976-1 (CAS 896375-44-3), with molecular formula C20H22N2O3S and molecular weight 370.14 g/mol. IUPAC: N-[(4-methylphenyl)methyl]-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide.
Chemical Property Profile of VU0491976-1
Property Insights of VU0491976-1
The XLogP value of 2.69892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0491976-1. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0491976-1. Following Lipinski's Rule of Five, VU0491976-1 has 1 hydrogen bond donor(s) and 3 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 VU0491976-1?
The CAS number of VU0491976-1 is 896375-44-3.
What is the molecular formula of VU0491976-1?
The molecular formula of VU0491976-1 is C20H22N2O3S.
What is the molecular weight of VU0491976-1?
The molecular weight of VU0491976-1 is 370.14 g/mol.
Where can I buy VU0491976-1?
You can request a quote for VU0491976-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0491976-1?
Yes, KEHONG BIO provides custom synthesis services for VU0491976-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.