F0507-0052
TL;DR: F0507-0052 (CAS 391897-40-8) is a chemical compound with molecular formula C25H21Cl2N5O2S and molecular weight 525.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3,4-dichlorophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0507-0052, N-((4-(3,4-dichlorophenyl)-5-((2-oxo-2-(m-tolylamino)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)benzamide, N-{[4-(3,4-dichlorophenyl)-5-({[(3-methylphenyl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide, N-[[4-(3,4-dichlorophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
| Molecular Formula | C25H21Cl2N5O2S |
|---|---|
| Molecular Weight | 525.08 g/mol |
| LogP | 5.54332 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 525.0793 |
| Heavy Atoms | 35 |
| Complexity | 1361.2367 |
Chemical Identifiers
| CAS Number | 391897-40-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC(=C(C=C3)Cl)Cl)CNC(=O)C4=CC=CC=C4 |
Product Overview
F0507-0052 (CAS 391897-40-8), with molecular formula C25H21Cl2N5O2S and molecular weight 525.08 g/mol. IUPAC: N-[[4-(3,4-dichlorophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0507-0052
Property Insights of F0507-0052
The XLogP value of 5.54332 indicates that F0507-0052 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for F0507-0052. Following Lipinski's Rule of Five, F0507-0052 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0507-0052?
The CAS number of F0507-0052 is 391897-40-8.
What is the molecular formula of F0507-0052?
The molecular formula of F0507-0052 is C25H21Cl2N5O2S.
What is the molecular weight of F0507-0052?
The molecular weight of F0507-0052 is 525.08 g/mol.
Where can I buy F0507-0052?
You can request a quote for F0507-0052 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-0052?
Yes, KEHONG BIO provides custom synthesis services for F0507-0052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.