N,N,O-tris(trimethylsilyl) 2-aminoethanol
TL;DR: N,N,O-tris(trimethylsilyl) 2-aminoethanol (CAS 5630-81-9) is a chemical compound with molecular formula C17H12ClN5O5 and molecular weight 401.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-4-[(3,5-dinitrophenyl)iminomethyl]-5-methyl-1H-pyrazol-3-one
Also Known As: N,N,O-tris(trimethylsilyl) 2-aminoethanol, N-(2-trimethylsiloxyethyl)hexamethyldisilazane, (4Z)-2-(4-chlorophenyl)-4-[(3,5-dinitroanilino)methylidene]-5-methylpyrazol-3-one, 2-(4-chlorophenyl)-4-[(3,5-dinitroanilino)methylidene]-5-methylpyrazol-3-one, (4E)-2-(4-chlorophenyl)-4-{[(3,5-dinitrophenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C17H12ClN5O5 |
|---|---|
| Molecular Weight | 401.05 g/mol |
| LogP | 3.69442 |
| Topological Polar Surface Area | 136.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.0527 |
| Heavy Atoms | 28 |
| Complexity | 1131.4215 |
Chemical Identifiers
| CAS Number | 5630-81-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C=NC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N,N,O-tris(trimethylsilyl) 2-aminoethanol (CAS 5630-81-9), with molecular formula C17H12ClN5O5 and molecular weight 401.05 g/mol. IUPAC: 2-(4-chlorophenyl)-4-[(3,5-dinitrophenyl)iminomethyl]-5-methyl-1H-pyrazol-3-one.
Chemical Property Profile of N,N,O-tris(trimethylsilyl) 2-aminoethanol
Property Insights of N,N,O-tris(trimethylsilyl) 2-aminoethanol
The XLogP value of 3.69442 indicates that N,N,O-tris(trimethylsilyl) 2-aminoethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N,O-tris(trimethylsilyl) 2-aminoethanol. Following Lipinski's Rule of Five, N,N,O-tris(trimethylsilyl) 2-aminoethanol has 1 hydrogen bond donor(s) and 6 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,O-tris(trimethylsilyl) 2-aminoethanol?
The CAS number of N,N,O-tris(trimethylsilyl) 2-aminoethanol is 5630-81-9.
What is the molecular formula of N,N,O-tris(trimethylsilyl) 2-aminoethanol?
The molecular formula of N,N,O-tris(trimethylsilyl) 2-aminoethanol is C17H12ClN5O5.
What is the molecular weight of N,N,O-tris(trimethylsilyl) 2-aminoethanol?
The molecular weight of N,N,O-tris(trimethylsilyl) 2-aminoethanol is 401.05 g/mol.
Where can I buy N,N,O-tris(trimethylsilyl) 2-aminoethanol?
You can request a quote for N,N,O-tris(trimethylsilyl) 2-aminoethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N,O-tris(trimethylsilyl) 2-aminoethanol?
Yes, KEHONG BIO provides custom synthesis services for N,N,O-tris(trimethylsilyl) 2-aminoethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.