N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide
TL;DR: N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide (CAS 326902-68-5) is a chemical compound with molecular formula C17H17ClN2O2 and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-4-carboxamide
Also Known As: BAS 00628960, N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide, 3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carboxylic acid diallylamide, 3-(2-CHLOROPHENYL)-5-METHYL-N,N-BIS(PROP-2-EN-1-YL)-1,2-OXAZOLE-4-CARBOXAMIDE, 3-(2-chlorophenyl)-5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-4-carboxamide
| Molecular Formula | C17H17ClN2O2 |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 4.11762 |
| Topological Polar Surface Area | 46.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.09787 |
| Heavy Atoms | 22 |
| Complexity | 696.4346 |
Chemical Identifiers
| CAS Number | 326902-68-5 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N(CC=C)CC=C |
Product Overview
N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide (CAS 326902-68-5), with molecular formula C17H17ClN2O2 and molecular weight 316.10 g/mol. IUPAC: 3-(2-chlorophenyl)-5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-4-carboxamide.
Chemical Property Profile of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide
Property Insights of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide
The XLogP value of 4.11762 indicates that N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.34 Ų, N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide has 0 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,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide?
The CAS number of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide is 326902-68-5.
What is the molecular formula of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide?
The molecular formula of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide is C17H17ClN2O2.
What is the molecular weight of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide?
The molecular weight of N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide is 316.10 g/mol.
Where can I buy N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide?
You can request a quote for N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diallyl-3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.