N-(1,2,4-triazol-4-yl)cycloheptanimine
TL;DR: N-(1,2,4-triazol-4-yl)cycloheptanimine (CAS 326026-64-6) is a chemical compound with molecular formula C9H14N4 and molecular weight 178.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,2,4-triazol-4-yl)cycloheptanimine
Also Known As: N-(1,2,4-triazol-4-yl)cycloheptanimine, N-cycloheptylidene-4H-1,2,4-triazol-4-amine, BAS 00672013, Cycloheptylidene-[1,2,4]triazol-4-yl-amine, N-cycloheptylidene-N-(4H-1,2,4-triazol-4-yl)amine
| Molecular Formula | C9H14N4 |
|---|---|
| Molecular Weight | 178.12 g/mol |
| LogP | 1.8364 |
| Topological Polar Surface Area | 43.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.12184 |
| Heavy Atoms | 13 |
| Complexity | 265.81464 |
Chemical Identifiers
| CAS Number | 326026-64-6 |
|---|---|
| SMILES | C1CCCC(=NN2C=NN=C2)CC1 |
Product Overview
N-(1,2,4-triazol-4-yl)cycloheptanimine (CAS 326026-64-6), with molecular formula C9H14N4 and molecular weight 178.12 g/mol. IUPAC: N-(1,2,4-triazol-4-yl)cycloheptanimine.
Chemical Property Profile of N-(1,2,4-triazol-4-yl)cycloheptanimine
Property Insights of N-(1,2,4-triazol-4-yl)cycloheptanimine
The XLogP value of 1.8364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,2,4-triazol-4-yl)cycloheptanimine. With a topological polar surface area (TPSA) of 43.07 Ų, N-(1,2,4-triazol-4-yl)cycloheptanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,2,4-triazol-4-yl)cycloheptanimine 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-(1,2,4-triazol-4-yl)cycloheptanimine?
The CAS number of N-(1,2,4-triazol-4-yl)cycloheptanimine is 326026-64-6.
What is the molecular formula of N-(1,2,4-triazol-4-yl)cycloheptanimine?
The molecular formula of N-(1,2,4-triazol-4-yl)cycloheptanimine is C9H14N4.
What is the molecular weight of N-(1,2,4-triazol-4-yl)cycloheptanimine?
The molecular weight of N-(1,2,4-triazol-4-yl)cycloheptanimine is 178.12 g/mol.
Where can I buy N-(1,2,4-triazol-4-yl)cycloheptanimine?
You can request a quote for N-(1,2,4-triazol-4-yl)cycloheptanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,2,4-triazol-4-yl)cycloheptanimine?
Yes, KEHONG BIO provides custom synthesis services for N-(1,2,4-triazol-4-yl)cycloheptanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.