Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester
TL;DR: Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester (CAS 78149-98-1) is a chemical compound with molecular formula C6H14N5O2P and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[dimethylamino(ethoxy)phosphoryl]-1,2,4-triazol-3-amine
Also Known As: WP176, ((5-Amino)-1H-1,2,4-triazol-1-yl)-N,N-dimethylphosphonic amide ethyl ester, Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester, 2-[dimethylamino(ethoxy)phosphoryl]-1,2,4-triazol-3-amine, 1-[(dimethylamino)(ethoxy)phosphoryl]-1H-1,2,4-triazol-5-amine
| Molecular Formula | C6H14N5O2P |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 0.4146 |
| Topological Polar Surface Area | 86.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 219.08852 |
| Heavy Atoms | 14 |
| Complexity | 349.746 |
Chemical Identifiers
| CAS Number | 78149-98-1 |
|---|---|
| SMILES | CCOP(=O)(N1C(=NC=N1)N)N(C)C |
Product Overview
Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester (CAS 78149-98-1), with molecular formula C6H14N5O2P and molecular weight 219.09 g/mol. IUPAC: 2-[dimethylamino(ethoxy)phosphoryl]-1,2,4-triazol-3-amine.
Chemical Property Profile of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester
Property Insights of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester
The XLogP value of 0.4146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester. The TPSA of 86.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester. Following Lipinski's Rule of Five, Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester has 1 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 Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester?
The CAS number of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester is 78149-98-1.
What is the molecular formula of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester?
The molecular formula of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester is C6H14N5O2P.
What is the molecular weight of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester?
The molecular weight of Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester is 219.09 g/mol.
Where can I buy Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester?
You can request a quote for Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic amide, (5-amino-1H-1,2,4-triazol-1-yl)-N,N-dimethyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.