C25H32N3O2.Cl
TL;DR: C25H32N3O2.Cl (CAS 71550-25-9) is a chemical compound with molecular formula C25H32ClN3O2 and molecular weight 441.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-3-[4-[benzyl(ethyl)amino]-2-methylphenyl]-2-cyanoprop-2-enoyl]oxyethyl-trimethylazanium chloride
Also Known As: Ethanaminium, 2-((2-cyano-3-(4-(ethyl(phenylmethyl)amino)-2-methylphenyl)-1-oxo-2-propen-1-yl)oxy)-N,N,N-trimethyl-, chloride (1:1), Ethanaminium, 2-((2-cyano-3-(4-(ethyl(phenylmethyl)amino)-2-methylphenyl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethyl-, chloride, Ethanaminium, 2-[[2-cyano-3-[4-[ethyl(phenylmethyl)amino]-2-methylphenyl]-1-oxo-2-propenyl]oxy]-N,N,N-trimethyl-, chloride
| Molecular Formula | C25H32ClN3O2 |
|---|---|
| Molecular Weight | 441.22 g/mol |
| LogP | 1.1819 |
| Topological Polar Surface Area | 53.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 441.2183 |
| Heavy Atoms | 31 |
| Complexity | 928.0187 |
Chemical Identifiers
| CAS Number | 71550-25-9 |
|---|---|
| SMILES | CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)/C=C(\C#N)/C(=O)OCC[N+](C)(C)C)C.[Cl-] |
Product Overview
C25H32N3O2.Cl (CAS 71550-25-9), with molecular formula C25H32ClN3O2 and molecular weight 441.22 g/mol. IUPAC: 2-[(E)-3-[4-[benzyl(ethyl)amino]-2-methylphenyl]-2-cyanoprop-2-enoyl]oxyethyl-trimethylazanium chloride.
Chemical Property Profile of C25H32N3O2.Cl
Property Insights of C25H32N3O2.Cl
The XLogP value of 1.1819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C25H32N3O2.Cl. With a topological polar surface area (TPSA) of 53.33 Ų, C25H32N3O2.Cl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C25H32N3O2.Cl has 0 hydrogen bond donor(s) and 4 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 C25H32N3O2.Cl?
The CAS number of C25H32N3O2.Cl is 71550-25-9.
What is the molecular formula of C25H32N3O2.Cl?
The molecular formula of C25H32N3O2.Cl is C25H32ClN3O2.
What is the molecular weight of C25H32N3O2.Cl?
The molecular weight of C25H32N3O2.Cl is 441.22 g/mol.
Where can I buy C25H32N3O2.Cl?
You can request a quote for C25H32N3O2.Cl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H32N3O2.Cl?
Yes, KEHONG BIO provides custom synthesis services for C25H32N3O2.Cl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.