Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-
TL;DR: Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- (CAS 78915-45-4) is a chemical compound with molecular formula C22H24N4O4 and molecular weight 408.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(4-ethoxycarbonylphenyl)methyl]-N-[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamimidate
Also Known As: Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-, N'-[(4-ethoxycarbonylphenyl)methyl]-N-[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamimidate, RefChem:1099322, BRN 5797528
| Molecular Formula | C22H24N4O4 |
|---|---|
| Molecular Weight | 408.18 g/mol |
| LogP | 2.2709 |
| Topological Polar Surface Area | 103.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 408.17975 |
| Heavy Atoms | 30 |
| Complexity | 983.88684 |
Chemical Identifiers
| CAS Number | 78915-45-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)CN=C(NC2=C[N+](=NO2)C(C)CC3=CC=CC=C3)[O-] |
Product Overview
Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- (CAS 78915-45-4), with molecular formula C22H24N4O4 and molecular weight 408.18 g/mol. IUPAC: N'-[(4-ethoxycarbonylphenyl)methyl]-N-[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamimidate.
Chemical Property Profile of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-
Property Insights of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-
The XLogP value of 2.2709 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-. The TPSA of 103.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-. Following Lipinski's Rule of Five, Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- 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 Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
The CAS number of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- is 78915-45-4.
What is the molecular formula of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
The molecular formula of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- is C22H24N4O4.
What is the molecular weight of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
The molecular weight of Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- is 408.18 g/mol.
Where can I buy Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
You can request a quote for Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Sydnone imine, N-(((4-(ethoxycarbonyl)phenyl)methyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.