F0772-0605
TL;DR: F0772-0605 (CAS 309968-66-9) is a chemical compound with molecular formula C31H34N6O8S2 and molecular weight 682.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(2,5-dimethoxyphenyl)-5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide
Also Known As: F0772-0605, N-((4-(2,5-dimethoxyphenyl)-5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-4-(morpholinosulfonyl)benzamide, N-[[4-(2,5-dimethoxyphenyl)-5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide, N-{[4-(2,5-dimethoxyphenyl)-5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-4-(morpholine-4-sulfonyl)benzamide
| Molecular Formula | C31H34N6O8S2 |
|---|---|
| Molecular Weight | 682.19 g/mol |
| LogP | 2.9748 |
| Topological Polar Surface Area | 163.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 682.1879 |
| Heavy Atoms | 47 |
| Complexity | 1808.6682 |
Chemical Identifiers
| CAS Number | 309968-66-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=C(C=CC(=C3)OC)OC)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5 |
Product Overview
F0772-0605 (CAS 309968-66-9), with molecular formula C31H34N6O8S2 and molecular weight 682.19 g/mol. IUPAC: N-[[4-(2,5-dimethoxyphenyl)-5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of F0772-0605
Property Insights of F0772-0605
The XLogP value of 2.9748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0772-0605. The TPSA of 163.21 Ų indicates high polarity, suggesting F0772-0605 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0772-0605 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 F0772-0605?
The CAS number of F0772-0605 is 309968-66-9.
What is the molecular formula of F0772-0605?
The molecular formula of F0772-0605 is C31H34N6O8S2.
What is the molecular weight of F0772-0605?
The molecular weight of F0772-0605 is 682.19 g/mol.
Where can I buy F0772-0605?
You can request a quote for F0772-0605 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0772-0605?
Yes, KEHONG BIO provides custom synthesis services for F0772-0605 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.