VU0513357-1
TL;DR: VU0513357-1 (CAS 871322-85-9) is a chemical compound with molecular formula C17H14F3NO3 and molecular weight 337.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: VU0513357-1, 3-methyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide, F3215-0231, 2-methyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, (3-methyl(2H,3H-benzo[e]1,4-dioxan-2-yl))-N-[3-(trifluoromethyl)phenyl]carboxa mide
| Molecular Formula | C17H14F3NO3 |
|---|---|
| Molecular Weight | 337.09 g/mol |
| LogP | 3.8724 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.0926 |
| Heavy Atoms | 24 |
| Complexity | 760.74115 |
Chemical Identifiers
| CAS Number | 871322-85-9 |
|---|---|
| SMILES | CC1C(OC2=CC=CC=C2O1)C(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
VU0513357-1 (CAS 871322-85-9), with molecular formula C17H14F3NO3 and molecular weight 337.09 g/mol. IUPAC: 2-methyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of VU0513357-1
Property Insights of VU0513357-1
The XLogP value of 3.8724 indicates that VU0513357-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, VU0513357-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0513357-1 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 VU0513357-1?
The CAS number of VU0513357-1 is 871322-85-9.
What is the molecular formula of VU0513357-1?
The molecular formula of VU0513357-1 is C17H14F3NO3.
What is the molecular weight of VU0513357-1?
The molecular weight of VU0513357-1 is 337.09 g/mol.
Where can I buy VU0513357-1?
You can request a quote for VU0513357-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0513357-1?
Yes, KEHONG BIO provides custom synthesis services for VU0513357-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.