F0772-0613
TL;DR: F0772-0613 (CAS 309968-71-6) is a chemical compound with molecular formula C31H34N6O6S2 and molecular weight 650.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-ethoxyphenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide
Also Known As: F0772-0613, N-((4-(4-ethoxyphenyl)-5-((2-oxo-2-(m-tolylamino)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-4-(morpholinosulfonyl)benzamide, N-[[4-(4-ethoxyphenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide, N-{[4-(4-ethoxyphenyl)-5-({[(3-methylphenyl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-4-(morpholine-4-sulfonyl)benzamide
| Molecular Formula | C31H34N6O6S2 |
|---|---|
| Molecular Weight | 650.20 g/mol |
| LogP | 3.65612 |
| Topological Polar Surface Area | 144.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 650.1981 |
| Heavy Atoms | 45 |
| Complexity | 1737.1395 |
Chemical Identifiers
| CAS Number | 309968-71-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC(=C3)C)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5 |
Product Overview
F0772-0613 (CAS 309968-71-6), with molecular formula C31H34N6O6S2 and molecular weight 650.20 g/mol. IUPAC: N-[[4-(4-ethoxyphenyl)-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of F0772-0613
Property Insights of F0772-0613
The XLogP value of 3.65612 indicates that F0772-0613 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.75 Ų indicates high polarity, suggesting F0772-0613 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0772-0613 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 F0772-0613?
The CAS number of F0772-0613 is 309968-71-6.
What is the molecular formula of F0772-0613?
The molecular formula of F0772-0613 is C31H34N6O6S2.
What is the molecular weight of F0772-0613?
The molecular weight of F0772-0613 is 650.20 g/mol.
Where can I buy F0772-0613?
You can request a quote for F0772-0613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0772-0613?
Yes, KEHONG BIO provides custom synthesis services for F0772-0613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.