Phosphatidylcholine transfer protein inhibitor-1
TL;DR: Phosphatidylcholine transfer protein inhibitor-1 (CAS 379723-99-6) is a chemical compound with molecular formula C21H17ClFN3O3S2 and molecular weight 477.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-[(3-chlorophenyl)sulfamoyl]-4-methylphenyl]carbamothioyl]-4-fluorobenzamide
Also Known As: Phosphatidylcholine transfer protein inhibitor-1, N-((3-(N-(3-Chlorophenyl)sulfamoyl)-4-methylphenyl)carbamothioyl)-4-fluorobenzamide, N-[[3-[(3-chlorophenyl)sulfamoyl]-4-methylphenyl]carbamothioyl]-4-fluorobenzamide, N-[[3-[(3-chlorophenyl)sulfamoyl]-4-methylanilino]-sulfanylidenemethyl]-4-fluorobenzamide, N-[[3-[(3-chlorophenyl)sulfamoyl]-4-methyl-phenyl]thiocarbamoyl]-4-fluoro-benzamide
| Molecular Formula | C21H17ClFN3O3S2 |
|---|---|
| Molecular Weight | 477.04 g/mol |
| LogP | 4.71512 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.0384 |
| Heavy Atoms | 31 |
| Complexity | 1248.9797 |
Chemical Identifiers
| CAS Number | 379723-99-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F)S(=O)(=O)NC3=CC(=CC=C3)Cl |
Product Overview
Phosphatidylcholine transfer protein inhibitor-1 (CAS 379723-99-6), with molecular formula C21H17ClFN3O3S2 and molecular weight 477.04 g/mol. IUPAC: N-[[3-[(3-chlorophenyl)sulfamoyl]-4-methylphenyl]carbamothioyl]-4-fluorobenzamide.
Chemical Property Profile of Phosphatidylcholine transfer protein inhibitor-1
Property Insights of Phosphatidylcholine transfer protein inhibitor-1
The XLogP value of 4.71512 indicates that Phosphatidylcholine transfer protein inhibitor-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphatidylcholine transfer protein inhibitor-1. Following Lipinski's Rule of Five, Phosphatidylcholine transfer protein inhibitor-1 has 3 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 Phosphatidylcholine transfer protein inhibitor-1?
The CAS number of Phosphatidylcholine transfer protein inhibitor-1 is 379723-99-6.
What is the molecular formula of Phosphatidylcholine transfer protein inhibitor-1?
The molecular formula of Phosphatidylcholine transfer protein inhibitor-1 is C21H17ClFN3O3S2.
What is the molecular weight of Phosphatidylcholine transfer protein inhibitor-1?
The molecular weight of Phosphatidylcholine transfer protein inhibitor-1 is 477.04 g/mol.
Where can I buy Phosphatidylcholine transfer protein inhibitor-1?
You can request a quote for Phosphatidylcholine transfer protein inhibitor-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphatidylcholine transfer protein inhibitor-1?
Yes, KEHONG BIO provides custom synthesis services for Phosphatidylcholine transfer protein inhibitor-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.