F0507-1989
TL;DR: F0507-1989 (CAS 393841-28-6) is a chemical compound with molecular formula C29H31N5O3S and molecular weight 529.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0507-1989, 4-tert-butyl-N-{[5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzamide, 4-tert-butyl-N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide, 4-(tert-butyl)-N-((5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)benzamide, 4-tert-butyl-N-{[5-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzamide
| Molecular Formula | C29H31N5O3S |
|---|---|
| Molecular Weight | 529.21 g/mol |
| LogP | 5.2342 |
| Topological Polar Surface Area | 98.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 529.2148 |
| Heavy Atoms | 38 |
| Complexity | 1378.7433 |
Chemical Identifiers
| CAS Number | 393841-28-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)OC |
Product Overview
F0507-1989 (CAS 393841-28-6), with molecular formula C29H31N5O3S and molecular weight 529.21 g/mol. IUPAC: 4-tert-butyl-N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0507-1989
Property Insights of F0507-1989
The XLogP value of 5.2342 indicates that F0507-1989 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.14 Ų falls within the moderate polarity range, balancing permeability and solubility for F0507-1989. Following Lipinski's Rule of Five, F0507-1989 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0507-1989?
The CAS number of F0507-1989 is 393841-28-6.
What is the molecular formula of F0507-1989?
The molecular formula of F0507-1989 is C29H31N5O3S.
What is the molecular weight of F0507-1989?
The molecular weight of F0507-1989 is 529.21 g/mol.
Where can I buy F0507-1989?
You can request a quote for F0507-1989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-1989?
Yes, KEHONG BIO provides custom synthesis services for F0507-1989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.