VU0495721-1
TL;DR: VU0495721-1 (CAS 454231-01-7) is a chemical compound with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-phenyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Also Known As: VU0495721-1, AB00735958-01, N-ethyl-N-phenyl-2-(1,1,3-trioxo-2,3-dihydro-1lambda6,2-benzothiazol-2-yl)acetamide, F2748-0103, N-ethyl-N-phenyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08 g/mol |
| LogP | 1.8842 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 893.8164 |
Chemical Identifiers
| CAS Number | 454231-01-7 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O |
Product Overview
VU0495721-1 (CAS 454231-01-7), with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol. IUPAC: N-ethyl-N-phenyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide.
Chemical Property Profile of VU0495721-1
Property Insights of VU0495721-1
The XLogP value of 1.8842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0495721-1. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0495721-1. Following Lipinski's Rule of Five, VU0495721-1 has 0 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 VU0495721-1?
The CAS number of VU0495721-1 is 454231-01-7.
What is the molecular formula of VU0495721-1?
The molecular formula of VU0495721-1 is C17H16N2O4S.
What is the molecular weight of VU0495721-1?
The molecular weight of VU0495721-1 is 344.08 g/mol.
Where can I buy VU0495721-1?
You can request a quote for VU0495721-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0495721-1?
Yes, KEHONG BIO provides custom synthesis services for VU0495721-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.