F0507-4680
TL;DR: F0507-4680 (CAS 391939-53-0) is a chemical compound with molecular formula C23H20Cl2N6O2S2 and molecular weight 546.05 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-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethylbenzamide
Also Known As: F0507-4680, N-((4-(3,4-dichlorophenyl)-5-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-3,4-dimethylbenzamide, N-{[4-(3,4-dichlorophenyl)-5-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethylbenzamide, N-[[4-(3,4-dichlorophenyl)-5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethylbenzamide
| Molecular Formula | C23H20Cl2N6O2S2 |
|---|---|
| Molecular Weight | 546.05 g/mol |
| LogP | 5.30824 |
| Topological Polar Surface Area | 101.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 546.04663 |
| Heavy Atoms | 35 |
| Complexity | 1374.6011 |
Chemical Identifiers
| CAS Number | 391939-53-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC(=C(C=C3)Cl)Cl)SCC(=O)NC4=NC=CS4)C |
Product Overview
F0507-4680 (CAS 391939-53-0), with molecular formula C23H20Cl2N6O2S2 and molecular weight 546.05 g/mol. IUPAC: N-[[4-(3,4-dichlorophenyl)-5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethylbenzamide.
Chemical Property Profile of F0507-4680
Property Insights of F0507-4680
The XLogP value of 5.30824 indicates that F0507-4680 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 F0507-4680. Following Lipinski's Rule of Five, F0507-4680 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 F0507-4680?
The CAS number of F0507-4680 is 391939-53-0.
What is the molecular formula of F0507-4680?
The molecular formula of F0507-4680 is C23H20Cl2N6O2S2.
What is the molecular weight of F0507-4680?
The molecular weight of F0507-4680 is 546.05 g/mol.
Where can I buy F0507-4680?
You can request a quote for F0507-4680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-4680?
Yes, KEHONG BIO provides custom synthesis services for F0507-4680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.