F0508-0838
TL;DR: F0508-0838 (CAS 389071-31-2) is a chemical compound with molecular formula C27H26BrN5O4S and molecular weight 595.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-bromophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2,4-dimethoxybenzamide
Also Known As: F0508-0838, N-((4-(4-bromophenyl)-5-((2-oxo-2-(m-tolylamino)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2,4-dimethoxybenzamide, N-{[4-(4-bromophenyl)-5-({[(3-methylphenyl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-2,4-dimethoxybenzamide, N-[[4-(4-bromophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2,4-dimethoxybenzamide
| Molecular Formula | C27H26BrN5O4S |
|---|---|
| Molecular Weight | 595.09 g/mol |
| LogP | 5.01622 |
| Topological Polar Surface Area | 107.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 595.08887 |
| Heavy Atoms | 38 |
| Complexity | 1441.916 |
Chemical Identifiers
| CAS Number | 389071-31-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Br)CNC(=O)C4=C(C=C(C=C4)OC)OC |
Product Overview
F0508-0838 (CAS 389071-31-2), with molecular formula C27H26BrN5O4S and molecular weight 595.09 g/mol. IUPAC: N-[[4-(4-bromophenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2,4-dimethoxybenzamide.
Chemical Property Profile of F0508-0838
Property Insights of F0508-0838
The XLogP value of 5.01622 indicates that F0508-0838 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.37 Ų falls within the moderate polarity range, balancing permeability and solubility for F0508-0838. Following Lipinski's Rule of Five, F0508-0838 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0508-0838?
The CAS number of F0508-0838 is 389071-31-2.
What is the molecular formula of F0508-0838?
The molecular formula of F0508-0838 is C27H26BrN5O4S.
What is the molecular weight of F0508-0838?
The molecular weight of F0508-0838 is 595.09 g/mol.
Where can I buy F0508-0838?
You can request a quote for F0508-0838 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0508-0838?
Yes, KEHONG BIO provides custom synthesis services for F0508-0838 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.