F0721-0916
TL;DR: F0721-0916 (CAS 309967-95-1) is a chemical compound with molecular formula C30H29F3N6O6S2 and molecular weight 690.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide
Also Known As: F0721-0916, N-((5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)methyl)-4-(morpholinosulfonyl)benzamide, N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide, N-{[5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl}-4-(morpholine-4-sulfonyl)benzamide, p-[({5-[(N-p-methoxyphenylcarbamoyl)methylthio]-4-[m-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}methyl)carbamoyl]phenylmorpholino(oxo)-lambda-sulfaniumolate
| Molecular Formula | C30H29F3N6O6S2 |
|---|---|
| Molecular Weight | 690.15 g/mol |
| LogP | 3.9764 |
| Topological Polar Surface Area | 144.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 690.15424 |
| Heavy Atoms | 47 |
| Complexity | 1828.0369 |
Chemical Identifiers
| CAS Number | 309967-95-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5 |
Product Overview
F0721-0916 (CAS 309967-95-1), with molecular formula C30H29F3N6O6S2 and molecular weight 690.15 g/mol. IUPAC: N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of F0721-0916
Property Insights of F0721-0916
The XLogP value of 3.9764 indicates that F0721-0916 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.75 Ų indicates high polarity, suggesting F0721-0916 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0721-0916 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 F0721-0916?
The CAS number of F0721-0916 is 309967-95-1.
What is the molecular formula of F0721-0916?
The molecular formula of F0721-0916 is C30H29F3N6O6S2.
What is the molecular weight of F0721-0916?
The molecular weight of F0721-0916 is 690.15 g/mol.
Where can I buy F0721-0916?
You can request a quote for F0721-0916 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0916?
Yes, KEHONG BIO provides custom synthesis services for F0721-0916 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.