EINECS 269-580-2
TL;DR: EINECS 269-580-2 (CAS 68298-75-9) is a chemical compound with molecular formula C25H28F11N3O8S and molecular weight 739.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[2-[ethyl(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentylsulfonyl)amino]ethoxycarbonylamino]-2-methylphenyl]carbamoyloxy]propyl 2-methylprop-2-enoate
Also Known As: 2-((((5-(((2-(Ethyl((undecafluoropentyl)sulphonyl)amino)ethoxy)carbonyl)amino)-2-methylphenyl)amino)carbonyl)oxy)propyl methacrylate, 2-Propenoic acid, 2-methyl-, 2-[[[[5-[[[2-[ethyl[(undecafluoropentyl)sulfonyl]amino]ethoxy]carbonyl]amino]-2-methylphenyl]amino]carbonyl]oxy]propyl ester, 2-{[(5-{[(2-{ethyl[(undecafluoropentyl)sulfonyl]amino}ethoxy)carbonyl]amino}-2-methylphenyl)carbamoyl]oxy}propyl methacrylate, 2-({[5-({[2-(N-Ethyl-1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonamido)ethoxy]carbonyl}amino)-2-methylphenyl]carbamoyl}oxy)propyl 2-methylprop-2-enoate, 2-({[5-({[2-(N-ethyl1,1,2,2,3,3,4,4,5,5,5-undecafluoropentanesulfonamido)ethoxy]carbonyl}amino)-2-methylphenyl]carbamoyl}oxy)propyl 2-methylprop-2-enoate
| Molecular Formula | C25H28F11N3O8S |
|---|---|
| Molecular Weight | 739.14 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 18 |
| Exact Mass | 739.14215 |
| Heavy Atoms | 48 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 68298-75-9 |
|---|---|
| SMILES | CCN(CCOC(=O)NC1=CC(=C(C=C1)C)NC(=O)OC(C)COC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | OBPWLOPGKWGMTO-UHFFFAOYSA-N |
Product Overview
EINECS 269-580-2 (CAS 68298-75-9), with molecular formula C25H28F11N3O8S and molecular weight 739.14 g/mol. IUPAC: 2-[[5-[2-[ethyl(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentylsulfonyl)amino]ethoxycarbonylamino]-2-methylphenyl]carbamoyloxy]propyl 2-methylprop-2-enoate.
Chemical Property Profile of EINECS 269-580-2
Property Insights of EINECS 269-580-2
The XLogP value of 6.3 indicates that EINECS 269-580-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting EINECS 269-580-2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 269-580-2 has 2 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 269-580-2?
The CAS number of EINECS 269-580-2 is 68298-75-9.
What is the molecular formula of EINECS 269-580-2?
The molecular formula of EINECS 269-580-2 is C25H28F11N3O8S.
What is the molecular weight of EINECS 269-580-2?
The molecular weight of EINECS 269-580-2 is 739.14 g/mol.
Where can I buy EINECS 269-580-2?
You can request a quote for EINECS 269-580-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 269-580-2?
Yes, KEHONG BIO provides custom synthesis services for EINECS 269-580-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.