VU0491941-1
TL;DR: VU0491941-1 (CAS 898435-96-6) is a chemical compound with molecular formula C21H24N2O5S and molecular weight 416.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide
Also Known As: VU0491941-1, AB00970426-03, BRD-K34741278-001-06-6, F2665-0042, N-(3,4-dimethoxyphenethyl)-4-oxo-2,4,5,6-tetrahydro-1H-pyrrolo[3,2,1-ij]quinoline-8-sulfonamide
| Molecular Formula | C21H24N2O5S |
|---|---|
| Molecular Weight | 416.14 g/mol |
| LogP | 2.0601 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.1406 |
| Heavy Atoms | 29 |
| Complexity | 1064.9814 |
Chemical Identifiers
| CAS Number | 898435-96-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC3=C4C(=C2)CCN4C(=O)CC3)OC |
Product Overview
VU0491941-1 (CAS 898435-96-6), with molecular formula C21H24N2O5S and molecular weight 416.14 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide.
Chemical Property Profile of VU0491941-1
Property Insights of VU0491941-1
The XLogP value of 2.0601 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0491941-1. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0491941-1. Following Lipinski's Rule of Five, VU0491941-1 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 VU0491941-1?
The CAS number of VU0491941-1 is 898435-96-6.
What is the molecular formula of VU0491941-1?
The molecular formula of VU0491941-1 is C21H24N2O5S.
What is the molecular weight of VU0491941-1?
The molecular weight of VU0491941-1 is 416.14 g/mol.
Where can I buy VU0491941-1?
You can request a quote for VU0491941-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0491941-1?
Yes, KEHONG BIO provides custom synthesis services for VU0491941-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.