4-Azidosulpiride
TL;DR: 4-Azidosulpiride (CAS 98537-17-8) is a chemical compound with molecular formula C17H26N6O4S and molecular weight 420.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-azido-2-methoxy-5-(methylsulfamoyl)-N-[[(2S)-1-(2,2,3,3,3-pentatritiopropyl)pyrrolidin-2-yl]methyl]benzamide
Also Known As: 4-Azidosulpiride, Azidosulpride, 4-azido-2-methoxy-5-(methylsulfamoyl)-N-[[(2S)-1-(2,2,3,3,3-pentatritiopropyl)pyrrolidin-2-yl]methyl]benzamide, 4-Azido-2-methoxy-5-(methylsulfamoyl)-N-{[(2S)-1-(2,2,3,3,3-~3~H_5_)propylpyrrolidin-2-yl]methyl}benzene-1-carboximidic acid, 4-Azido-2-methoxy-5-(methylsulfamoyl)-N-{[1-(2,2,3,3,3-~3~H_5_)propylpyrrolidin-2-yl]methyl}benzene-1-carboximidic acid
| Molecular Formula | C17H26N6O4S |
|---|---|
| Molecular Weight | 420.21 g/mol |
| LogP | 2.1493 |
| Topological Polar Surface Area | 136.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 420.21475 |
| Heavy Atoms | 28 |
| Complexity | 1043.068 |
Chemical Identifiers
| CAS Number | 98537-17-8 |
|---|---|
| SMILES | [3H]C([3H])([3H])C([3H])([3H])CN1CCC[C@H]1CNC(=O)C2=CC(=C(C=C2OC)N=[N+]=[N-])S(=O)(=O)NC |
Product Overview
4-Azidosulpiride (CAS 98537-17-8), with molecular formula C17H26N6O4S and molecular weight 420.21 g/mol. IUPAC: 4-azido-2-methoxy-5-(methylsulfamoyl)-N-[[(2S)-1-(2,2,3,3,3-pentatritiopropyl)pyrrolidin-2-yl]methyl]benzamide.
Chemical Property Profile of 4-Azidosulpiride
Property Insights of 4-Azidosulpiride
The XLogP value of 2.1493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Azidosulpiride. The TPSA of 136.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Azidosulpiride. Following Lipinski's Rule of Five, 4-Azidosulpiride has 2 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 4-Azidosulpiride?
The CAS number of 4-Azidosulpiride is 98537-17-8.
What is the molecular formula of 4-Azidosulpiride?
The molecular formula of 4-Azidosulpiride is C17H26N6O4S.
What is the molecular weight of 4-Azidosulpiride?
The molecular weight of 4-Azidosulpiride is 420.21 g/mol.
Where can I buy 4-Azidosulpiride?
You can request a quote for 4-Azidosulpiride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Azidosulpiride?
Yes, KEHONG BIO provides custom synthesis services for 4-Azidosulpiride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.