N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide (CAS 879341-63-6) is a chemical compound with molecular formula C22H16N2O4 and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-3-phenylbenzo[c]isoxazole-5-carboxamide
| Molecular Formula | C22H16N2O4 |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | 4.1535 |
| Topological Polar Surface Area | 73.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.111 |
| Heavy Atoms | 28 |
| Complexity | 1167.8541 |
Chemical Identifiers
| CAS Number | 879341-63-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide (CAS 879341-63-6), with molecular formula C22H16N2O4 and molecular weight 372.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide
The XLogP value of 4.1535 indicates that N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.59 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-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-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide is 879341-63-6.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide is C22H16N2O4.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide is 372.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-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-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2,1-benzoxazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.