F0507-0171
TL;DR: F0507-0171 (CAS 393839-39-9) is a chemical compound with molecular formula C26H22N6O2S2 and molecular weight 514.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0507-0171, N-((5-((2-(benzo[d]thiazol-2-ylamino)-2-oxoethyl)thio)-4-(m-tolyl)-4H-1,2,4-triazol-3-yl)methyl)benzamide, N-{[5-({[(1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfanyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide, N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]benzamide
| Molecular Formula | C26H22N6O2S2 |
|---|---|
| Molecular Weight | 514.12 g/mol |
| LogP | 4.84622 |
| Topological Polar Surface Area | 101.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 514.1246 |
| Heavy Atoms | 36 |
| Complexity | 1497.047 |
Chemical Identifiers
| CAS Number | 393839-39-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3=NC4=CC=CC=C4S3)CNC(=O)C5=CC=CC=C5 |
Product Overview
F0507-0171 (CAS 393839-39-9), with molecular formula C26H22N6O2S2 and molecular weight 514.12 g/mol. IUPAC: N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0507-0171
Property Insights of F0507-0171
The XLogP value of 4.84622 indicates that F0507-0171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0507-0171. Following Lipinski's Rule of Five, F0507-0171 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 F0507-0171?
The CAS number of F0507-0171 is 393839-39-9.
What is the molecular formula of F0507-0171?
The molecular formula of F0507-0171 is C26H22N6O2S2.
What is the molecular weight of F0507-0171?
The molecular weight of F0507-0171 is 514.12 g/mol.
Where can I buy F0507-0171?
You can request a quote for F0507-0171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-0171?
Yes, KEHONG BIO provides custom synthesis services for F0507-0171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.