F0417-0639
TL;DR: F0417-0639 (CAS 392295-91-9) is a chemical compound with molecular formula C21H22N4O4S2 and molecular weight 458.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide
Also Known As: F0417-0639, N-[5-({[(2,4-dimethylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide, N-(5-((2-((2,4-dimethylphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4-dimethoxybenzamide, N-[5-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide, N-[5-[(2,4-dimethylphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,4-dimethoxy-benzamide
| Molecular Formula | C21H22N4O4S2 |
|---|---|
| Molecular Weight | 458.11 g/mol |
| LogP | 4.15524 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.10825 |
| Heavy Atoms | 31 |
| Complexity | 1100.7339 |
Chemical Identifiers
| CAS Number | 392295-91-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OC)OC)C |
Product Overview
F0417-0639 (CAS 392295-91-9), with molecular formula C21H22N4O4S2 and molecular weight 458.11 g/mol. IUPAC: N-[5-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide.
Chemical Property Profile of F0417-0639
Property Insights of F0417-0639
The XLogP value of 4.15524 indicates that F0417-0639 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-0639. Following Lipinski's Rule of Five, F0417-0639 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-0639?
The CAS number of F0417-0639 is 392295-91-9.
What is the molecular formula of F0417-0639?
The molecular formula of F0417-0639 is C21H22N4O4S2.
What is the molecular weight of F0417-0639?
The molecular weight of F0417-0639 is 458.11 g/mol.
Where can I buy F0417-0639?
You can request a quote for F0417-0639 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0639?
Yes, KEHONG BIO provides custom synthesis services for F0417-0639 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.