![1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine structure](/static/products/802/80212-88-0.png)
1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine
TL;DR: 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine (CAS 80212-88-0) is a chemical compound with molecular formula C16H19N5O2 and molecular weight 313.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine
Also Known As: 1-[3-cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine, 1-[1-Cyclopropyl-4-(4-nitrophenyl)-1H-1,2,3-triazol-5-yl]piperidine
| Molecular Formula | C16H19N5O2 |
|---|---|
| Molecular Weight | 313.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.15387 |
| Heavy Atoms | 23 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 80212-88-0 |
|---|---|
| SMILES | C1CCN(CC1)C2=C(N=NN2C3CC3)C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | XXQQVQAGAXQBAY-UHFFFAOYSA-N |
Product Overview
1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine (CAS 80212-88-0), with molecular formula C16H19N5O2 and molecular weight 313.15 g/mol. IUPAC: 1-[3-cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine.
Chemical Property Profile of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine
Property Insights of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine. Following Lipinski's Rule of Five, 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine has 0 hydrogen bond donor(s) and 5 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 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine?
The CAS number of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine is 80212-88-0.
What is the molecular formula of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine?
The molecular formula of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine is C16H19N5O2.
What is the molecular weight of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine?
The molecular weight of 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine is 313.15 g/mol.
Where can I buy 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine?
You can request a quote for 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-Cyclopropyl-5-(4-nitrophenyl)triazol-4-yl]piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.