4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine
TL;DR: 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine (CAS 74073-15-7) is a chemical compound with molecular formula C13H15N5O3 and molecular weight 289.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine
Also Known As: 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine, 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholin, Morpholine,4-[4,5-dihydro-4-methylene-1-(4-nitrophenyl)-1H-1,2,3-triazol-5-yl]-, 4-[4-Methylidene-1-(4-nitrophenyl)-4,5-dihydro-1H-1,2,3-triazol-5-yl]morpholine
| Molecular Formula | C13H15N5O3 |
|---|---|
| Molecular Weight | 289.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.1175 |
| Heavy Atoms | 21 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 74073-15-7 |
|---|---|
| SMILES | C=C1C(N(N=N1)C2=CC=C(C=C2)[N+](=O)[O-])N3CCOCC3 |
| InChIKey | YYNXYVOTRCBQFQ-UHFFFAOYSA-N |
Product Overview
4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine (CAS 74073-15-7), with molecular formula C13H15N5O3 and molecular weight 289.12 g/mol. IUPAC: 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine.
Chemical Property Profile of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine
Property Insights of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine. Following Lipinski's Rule of Five, 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine has 0 hydrogen bond donor(s) and 7 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-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine?
The CAS number of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine is 74073-15-7.
What is the molecular formula of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine?
The molecular formula of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine is C13H15N5O3.
What is the molecular weight of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine?
The molecular weight of 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine is 289.12 g/mol.
Where can I buy 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine?
You can request a quote for 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[5-methylidene-3-(4-nitrophenyl)-4H-triazol-4-yl]morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.