![4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine structure](/static/products/836/836665-40-8.png)
4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine
TL;DR: 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine (CAS 836665-40-8) is a chemical compound with molecular formula C16H17N3O4 and molecular weight 315.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl]morpholine
Also Known As: 4-{4-[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine, (E)-4-(4-(2-(3-methyl-4-nitroisoxazol-5-yl)vinyl)phenyl)morpholine, 4-[4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl]morpholine, 4-{4-[(1E)-2-(3-METHYL-4-NITRO-1,2-OXAZOL-5-YL)ETHENYL]PHENYL}MORPHOLINE
| Molecular Formula | C16H17N3O4 |
|---|---|
| Molecular Weight | 315.12 g/mol |
| LogP | 2.89822 |
| Topological Polar Surface Area | 81.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.12192 |
| Heavy Atoms | 23 |
| Complexity | 715.42664 |
Chemical Identifiers
| CAS Number | 836665-40-8 |
|---|---|
| SMILES | CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=CC=C(C=C2)N3CCOCC3 |
Product Overview
4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine (CAS 836665-40-8), with molecular formula C16H17N3O4 and molecular weight 315.12 g/mol. IUPAC: 4-[4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl]morpholine.
Chemical Property Profile of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine
Property Insights of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine
The XLogP value of 2.89822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine. The TPSA of 81.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine. Following Lipinski's Rule of Five, 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine has 0 hydrogen bond donor(s) and 6 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 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine?
The CAS number of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine is 836665-40-8.
What is the molecular formula of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine?
The molecular formula of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine is C16H17N3O4.
What is the molecular weight of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine?
The molecular weight of 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine is 315.12 g/mol.
Where can I buy 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine?
You can request a quote for 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-{4-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]phenyl}morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.