F0721-1044
TL;DR: F0721-1044 (CAS 394215-45-3) is a chemical compound with molecular formula C21H21N7O3S4 and molecular weight 547.06 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-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
Also Known As: F0721-1044, N-({5-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl}methyl)thiophene-2-carboxamide, N-((5-((2-((5-(ethylthio)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl)methyl)thiophene-2-carboxamide, N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
| Molecular Formula | C21H21N7O3S4 |
|---|---|
| Molecular Weight | 547.06 g/mol |
| LogP | 3.9617 |
| Topological Polar Surface Area | 123.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 547.0589 |
| Heavy Atoms | 35 |
| Complexity | 1289.836 |
Chemical Identifiers
| CAS Number | 394215-45-3 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3OC)CNC(=O)C4=CC=CS4 |
Product Overview
F0721-1044 (CAS 394215-45-3), with molecular formula C21H21N7O3S4 and molecular weight 547.06 g/mol. IUPAC: N-[[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide.
Chemical Property Profile of F0721-1044
Property Insights of F0721-1044
The XLogP value of 3.9617 indicates that F0721-1044 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.92 Ų falls within the moderate polarity range, balancing permeability and solubility for F0721-1044. Following Lipinski's Rule of Five, F0721-1044 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0721-1044?
The CAS number of F0721-1044 is 394215-45-3.
What is the molecular formula of F0721-1044?
The molecular formula of F0721-1044 is C21H21N7O3S4.
What is the molecular weight of F0721-1044?
The molecular weight of F0721-1044 is 547.06 g/mol.
Where can I buy F0721-1044?
You can request a quote for F0721-1044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-1044?
Yes, KEHONG BIO provides custom synthesis services for F0721-1044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.