N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide (CAS 314022-63-4) is a chemical compound with molecular formula C14H9F2NO3 and molecular weight 277.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide
Also Known As: BAS 00539721, N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide, UPCMLD0ENAT5691370:001, BIM-0022346.P001, AB00087180-01
| Molecular Formula | C14H9F2NO3 |
|---|---|
| Molecular Weight | 277.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.05505 |
| Heavy Atoms | 20 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 314022-63-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)F |
| InChIKey | FUAQGUDITXGNRU-UHFFFAOYSA-N |
Product Overview
N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide (CAS 314022-63-4), with molecular formula C14H9F2NO3 and molecular weight 277.06 g/mol. IUPAC: N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide. With a topological polar surface area (TPSA) of 47.6 Ų, N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide 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 N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide is 314022-63-4.
What is the molecular formula of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide is C14H9F2NO3.
What is the molecular weight of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide is 277.06 g/mol.
Where can I buy N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-difluorophenyl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.