F0508-2730
TL;DR: F0508-2730 (CAS 391949-13-6) is a chemical compound with molecular formula C26H24ClN5O2S and molecular weight 505.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3-chlorophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide
Also Known As: F0508-2730, 2-{[4-(3-chlorophenyl)-5-[(2-phenylacetamido)methyl]-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide, N-((4-(3-chlorophenyl)-5-((2-oxo-2-(m-tolylamino)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2-phenylacetamide, N-[[4-(3-chlorophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide, N-m-tolyl{5-[(benzylcarbonylamino)methyl]-4-(m-chlorophenyl)-4H-1,2,4-triazol-3-ylthio}acetamide
| Molecular Formula | C26H24ClN5O2S |
|---|---|
| Molecular Weight | 505.13 g/mol |
| LogP | 4.81882 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 505.1339 |
| Heavy Atoms | 35 |
| Complexity | 1326.3389 |
Chemical Identifiers
| CAS Number | 391949-13-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)CNC(=O)CC4=CC=CC=C4 |
Product Overview
F0508-2730 (CAS 391949-13-6), with molecular formula C26H24ClN5O2S and molecular weight 505.13 g/mol. IUPAC: N-[[4-(3-chlorophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide.
Chemical Property Profile of F0508-2730
Property Insights of F0508-2730
The XLogP value of 4.81882 indicates that F0508-2730 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 F0508-2730. Following Lipinski's Rule of Five, F0508-2730 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 F0508-2730?
The CAS number of F0508-2730 is 391949-13-6.
What is the molecular formula of F0508-2730?
The molecular formula of F0508-2730 is C26H24ClN5O2S.
What is the molecular weight of F0508-2730?
The molecular weight of F0508-2730 is 505.13 g/mol.
Where can I buy F0508-2730?
You can request a quote for F0508-2730 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0508-2730?
Yes, KEHONG BIO provides custom synthesis services for F0508-2730 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.