F0721-0698
TL;DR: F0721-0698 (CAS 393875-01-9) is a chemical compound with molecular formula C27H31N7O4S3 and molecular weight 613.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-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]benzamide
Also Known As: F0721-0698, 4-butoxy-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)benzamide, 4-butoxy-N-({5-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl}methyl)benzamide, 4-butoxy-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]benzamide
| Molecular Formula | C27H31N7O4S3 |
|---|---|
| Molecular Weight | 613.16 g/mol |
| LogP | 5.0791 |
| Topological Polar Surface Area | 133.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 15 |
| Exact Mass | 613.16 |
| Heavy Atoms | 41 |
| Complexity | 1442.9497 |
Chemical Identifiers
| CAS Number | 393875-01-9 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3OC)SCC(=O)NC4=NN=C(S4)SCC |
Product Overview
F0721-0698 (CAS 393875-01-9), with molecular formula C27H31N7O4S3 and molecular weight 613.16 g/mol. IUPAC: 4-butoxy-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]benzamide.
Chemical Property Profile of F0721-0698
Property Insights of F0721-0698
The XLogP value of 5.0791 indicates that F0721-0698 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.15 Ų falls within the moderate polarity range, balancing permeability and solubility for F0721-0698. Following Lipinski's Rule of Five, F0721-0698 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 F0721-0698?
The CAS number of F0721-0698 is 393875-01-9.
What is the molecular formula of F0721-0698?
The molecular formula of F0721-0698 is C27H31N7O4S3.
What is the molecular weight of F0721-0698?
The molecular weight of F0721-0698 is 613.16 g/mol.
Where can I buy F0721-0698?
You can request a quote for F0721-0698 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0698?
Yes, KEHONG BIO provides custom synthesis services for F0721-0698 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.