Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-
TL;DR: Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- (CAS 78915-40-9) is a chemical compound with molecular formula C19H18N4O4 and molecular weight 366.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamoylamino]benzoate
Also Known As: Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-, N-(((4-Carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)sydnone imine sodium salt, 4-[[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamoylamino]benzoate, RefChem:1099323, BRN 5796841
| Molecular Formula | C19H18N4O4 |
|---|---|
| Molecular Weight | 366.13 g/mol |
| LogP | 1.7733 |
| Topological Polar Surface Area | 111.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.1328 |
| Heavy Atoms | 27 |
| Complexity | 922.3974 |
Chemical Identifiers
| CAS Number | 78915-40-9 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)[N+]2=NOC(=C2)NC(=O)NC3=CC=C(C=C3)C(=O)[O-] |
Product Overview
Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- (CAS 78915-40-9), with molecular formula C19H18N4O4 and molecular weight 366.13 g/mol. IUPAC: 4-[[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamoylamino]benzoate.
Chemical Property Profile of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-
Property Insights of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-
The XLogP value of 1.7733 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-. The TPSA of 111.17 Ų falls within the moderate polarity range, balancing permeability and solubility for Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-. Following Lipinski's Rule of Five, Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- has 2 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 Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
The CAS number of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- is 78915-40-9.
What is the molecular formula of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
The molecular formula of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- is C19H18N4O4.
What is the molecular weight of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
The molecular weight of Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- is 366.13 g/mol.
Where can I buy Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
You can request a quote for Sydnone imine, N-(((4-carboxyphenyl)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-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Sydnone imine, N-(((4-carboxyphenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.