N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide
TL;DR: N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide (CAS 55433-45-9) is a chemical compound with molecular formula C13H17N5 and molecular weight 243.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-N'-phenyl-1,2,4-triazole-1-carboximidamide
Also Known As: BIM-0021458.P001, (Z)-N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide, N,N-diethyl-N'-phenyl-1,2,4-triazole-1-carboximidamide, N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide
| Molecular Formula | C13H17N5 |
|---|---|
| Molecular Weight | 243.15 g/mol |
| LogP | 2.1557 |
| Topological Polar Surface Area | 46.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.14839 |
| Heavy Atoms | 18 |
| Complexity | 485.36487 |
Chemical Identifiers
| CAS Number | 55433-45-9 |
|---|---|
| SMILES | CCN(CC)C(=NC1=CC=CC=C1)N2C=NC=N2 |
Product Overview
N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide (CAS 55433-45-9), with molecular formula C13H17N5 and molecular weight 243.15 g/mol. IUPAC: N,N-diethyl-N'-phenyl-1,2,4-triazole-1-carboximidamide.
Chemical Property Profile of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide
Property Insights of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide
The XLogP value of 2.1557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide. With a topological polar surface area (TPSA) of 46.31 Ų, N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide 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,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide?
The CAS number of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide is 55433-45-9.
What is the molecular formula of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide?
The molecular formula of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide is C13H17N5.
What is the molecular weight of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide?
The molecular weight of N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide is 243.15 g/mol.
Where can I buy N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide?
You can request a quote for N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-N'-phenyl-1H-1,2,4-triazole-1-carboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.