Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride
TL;DR: Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride (CAS 40546-33-6) is a chemical compound with molecular formula C17H18ClN3O and molecular weight 315.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-diphenylpropan-2-yl)oxadiazol-3-ium-5-amine chloride
Also Known As: 3-(alpha-Benzylphenethyl)sydnone imine hydrochloride, 3-(1,3-Diphenylprop-2-yl)sydnone imine monohydrochloride, Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride, 5-amino-3-(1,3-diphenylpropan-2-yl)-1,2,3-oxadiazol-3-ium chloride, 3-(1,3-diphenylpropan-2-yl)oxadiazol-3-ium-5-amine chloride
| Molecular Formula | C17H18ClN3O |
|---|---|
| Molecular Weight | 315.11 g/mol |
| LogP | -0.4252 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.11383 |
| Heavy Atoms | 22 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 40546-33-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(CC2=CC=CC=C2)[N+]3=NOC(=C3)N.[Cl-] |
| InChIKey | WAIDMTXGLYZKDR-UHFFFAOYSA-M |
Product Overview
Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride (CAS 40546-33-6), with molecular formula C17H18ClN3O and molecular weight 315.11 g/mol. IUPAC: 3-(1,3-diphenylpropan-2-yl)oxadiazol-3-ium-5-amine chloride.
Chemical Property Profile of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride
Property Insights of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride
The XLogP value of -0.4252 indicates that Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.9 Ų, Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride has 1 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 Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride?
The CAS number of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride is 40546-33-6.
What is the molecular formula of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride?
The molecular formula of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride is C17H18ClN3O.
What is the molecular weight of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride?
The molecular weight of Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride is 315.11 g/mol.
Where can I buy Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride?
You can request a quote for Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Sydnone imine, 3-(1,3-diphenylprop-2-yl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.