F0721-0118
TL;DR: F0721-0118 (CAS 393840-38-5) is a chemical compound with molecular formula C22H19F2N7O2S3 and molecular weight 547.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide
Also Known As: F0721-0118, N-((5-((2-((5-(ethylthio)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl)methyl)-3-fluorobenzamide, N-({5-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl}methyl)-3-fluorobenzamide, N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide
| Molecular Formula | C22H19F2N7O2S3 |
|---|---|
| Molecular Weight | 547.07 g/mol |
| LogP | 4.1698 |
| Topological Polar Surface Area | 114.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 547.07306 |
| Heavy Atoms | 36 |
| Complexity | 1361.943 |
Chemical Identifiers
| CAS Number | 393840-38-5 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)CNC(=O)C4=CC(=CC=C4)F |
Product Overview
F0721-0118 (CAS 393840-38-5), with molecular formula C22H19F2N7O2S3 and molecular weight 547.07 g/mol. IUPAC: N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide.
Chemical Property Profile of F0721-0118
Property Insights of F0721-0118
The XLogP value of 4.1698 indicates that F0721-0118 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.69 Ų falls within the moderate polarity range, balancing permeability and solubility for F0721-0118. Following Lipinski's Rule of Five, F0721-0118 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0721-0118?
The CAS number of F0721-0118 is 393840-38-5.
What is the molecular formula of F0721-0118?
The molecular formula of F0721-0118 is C22H19F2N7O2S3.
What is the molecular weight of F0721-0118?
The molecular weight of F0721-0118 is 547.07 g/mol.
Where can I buy F0721-0118?
You can request a quote for F0721-0118 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0118?
Yes, KEHONG BIO provides custom synthesis services for F0721-0118 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.