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N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide
TL;DR: N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide (CAS 314055-31-7) is a chemical compound with molecular formula C15H9ClF3NO3 and molecular weight 343.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide
Also Known As: BIM-0023260.P001, N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide, AB00088166-01, 2H-benzo[3,4-d]1,3-dioxolen-5-yl-N-[2-chloro-5-(trifluoromethyl)phenyl]carboxa mide
| Molecular Formula | C15H9ClF3NO3 |
|---|---|
| Molecular Weight | 343.02 g/mol |
| LogP | 4.3398 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.0223 |
| Heavy Atoms | 23 |
| Complexity | 777.0478 |
Chemical Identifiers
| CAS Number | 314055-31-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide (CAS 314055-31-7), with molecular formula C15H9ClF3NO3 and molecular weight 343.02 g/mol. IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide
Property Insights of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide
The XLogP value of 4.3398 indicates that N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-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-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide?
The CAS number of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide is 314055-31-7.
What is the molecular formula of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide is C15H9ClF3NO3.
What is the molecular weight of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide is 343.02 g/mol.
Where can I buy N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-[2-chloro-5-(trifluoromethyl)phenyl]-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-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-chloro-5-(trifluoromethyl)phenyl]-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.