3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine
TL;DR: 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine (CAS 113614-50-9) is a chemical compound with molecular formula C20H19Cl2N3O and molecular weight 387.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-1,2-oxazolidine
Also Known As: PR 967234, 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine, (3S,5S)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-1,2-oxazolidine, (3S,5S)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-isoxazolidine, cis-3,5-Bis(4-chlorophenyl)-3-((1H-imidazol-1-yl)-methyl)-2-methylisoxazolidine
| Molecular Formula | C20H19Cl2N3O |
|---|---|
| Molecular Weight | 387.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 30.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.0905 |
| Heavy Atoms | 26 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 113614-50-9 |
|---|---|
| SMILES | CN1[C@](C[C@H](O1)C2=CC=C(C=C2)Cl)(CN3C=CN=C3)C4=CC=C(C=C4)Cl |
| InChIKey | JQNRGBCRWDMIDS-VQTJNVASSA-N |
Product Overview
3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine (CAS 113614-50-9), with molecular formula C20H19Cl2N3O and molecular weight 387.09 g/mol. IUPAC: (3S,5S)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-1,2-oxazolidine.
Chemical Property Profile of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine
Property Insights of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine
The XLogP value of 4.3 indicates that 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.3 Ų, 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine 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 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine?
The CAS number of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine is 113614-50-9.
What is the molecular formula of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine?
The molecular formula of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine is C20H19Cl2N3O.
What is the molecular weight of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine?
The molecular weight of 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine is 387.09 g/mol.
Where can I buy 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine?
You can request a quote for 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis-(4-chloro-phenyl)-3-imidazol-1-ylmethyl-2-methyl-isoxazolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.