VU0495751-1
TL;DR: VU0495751-1 (CAS 899995-56-3) is a chemical compound with molecular formula C16H10F4N2O4S and molecular weight 402.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Also Known As: VU0495751-1, F2748-0188, N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide, 2-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3H)-yl)-N-(4-fluoro-3-(trifluoromethyl)phenyl)acetamide, N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(1,1,3-trioxo-2,3-dihydro-1lambda6,2-benzothiazol-2-yl)acetamide
| Molecular Formula | C16H10F4N2O4S |
|---|---|
| Molecular Weight | 402.03 g/mol |
| LogP | 2.6277 |
| Topological Polar Surface Area | 83.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.02975 |
| Heavy Atoms | 27 |
| Complexity | 1050.6261 |
Chemical Identifiers
| CAS Number | 899995-56-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC(=O)NC3=CC(=C(C=C3)F)C(F)(F)F |
Product Overview
VU0495751-1 (CAS 899995-56-3), with molecular formula C16H10F4N2O4S and molecular weight 402.03 g/mol. IUPAC: N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide.
Chemical Property Profile of VU0495751-1
Property Insights of VU0495751-1
The XLogP value of 2.6277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0495751-1. The TPSA of 83.55 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0495751-1. Following Lipinski's Rule of Five, VU0495751-1 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 VU0495751-1?
The CAS number of VU0495751-1 is 899995-56-3.
What is the molecular formula of VU0495751-1?
The molecular formula of VU0495751-1 is C16H10F4N2O4S.
What is the molecular weight of VU0495751-1?
The molecular weight of VU0495751-1 is 402.03 g/mol.
Where can I buy VU0495751-1?
You can request a quote for VU0495751-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0495751-1?
Yes, KEHONG BIO provides custom synthesis services for VU0495751-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.