N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
TL;DR: N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide (CAS 449792-47-6) is a chemical compound with molecular formula C15H12FNO3 and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: IFLab1_002157, BAS 04854529, F0537-0335, N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide, 2H,3H-benzo[e]1,4-dioxan-2-yl-N-(3-fluorophenyl)carboxamide
| Molecular Formula | C15H12FNO3 |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 2.6042 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.0801 |
| Heavy Atoms | 20 |
| Complexity | 644.5207 |
Chemical Identifiers
| CAS Number | 449792-47-6 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C(=O)NC3=CC(=CC=C3)F |
Product Overview
N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide (CAS 449792-47-6), with molecular formula C15H12FNO3 and molecular weight 273.08 g/mol. IUPAC: N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Property Insights of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
The XLogP value of 2.6042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide 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 N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The CAS number of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is 449792-47-6.
What is the molecular formula of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The molecular formula of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is C15H12FNO3.
What is the molecular weight of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The molecular weight of N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is 273.08 g/mol.
Where can I buy N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
You can request a quote for N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.