5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide
TL;DR: 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide (CAS 712348-15-7) is a chemical compound with molecular formula C16H13N3O2 and molecular weight 279.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide
Also Known As: CBKinase1_008604, CBKinase1_021004, BAS 09529713, 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide, 5-phenyl-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide
| Molecular Formula | C16H13N3O2 |
|---|---|
| Molecular Weight | 279.10 g/mol |
| LogP | 2.6666 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.10077 |
| Heavy Atoms | 21 |
| Complexity | 723.5476 |
Chemical Identifiers
| CAS Number | 712348-15-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=NO2)C(=O)NCC3=CC=CC=N3 |
Product Overview
5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide (CAS 712348-15-7), with molecular formula C16H13N3O2 and molecular weight 279.10 g/mol. IUPAC: 5-phenyl-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide.
Chemical Property Profile of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide
Property Insights of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide
The XLogP value of 2.6666 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide. Following Lipinski's Rule of Five, 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide has 1 hydrogen bond donor(s) and 4 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 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide?
The CAS number of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide is 712348-15-7.
What is the molecular formula of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide?
The molecular formula of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide is C16H13N3O2.
What is the molecular weight of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide?
The molecular weight of 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide is 279.10 g/mol.
Where can I buy 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide?
You can request a quote for 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-phenyl-N-(2-pyridinylmethyl)-3-isoxazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.