RefChem:89224
TL;DR: RefChem:89224 (CAS 51160-59-9) is a chemical compound with molecular formula C31H42N2O10 and molecular weight 602.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[3-(2-ethylhexoxycarbonylamino)-2-methylphenyl]carbamoyloxymethyl]-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate
Also Known As: [2-[[3-(2-ethylhexoxycarbonylamino)-2-methylphenyl]carbamoyloxymethyl]-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate|2-Propenoic acid, 1,1'-(2-(((((3-((((2-ethylhexyl)oxy)carbonyl)amino)methylphenyl)amino)carbonyl)oxy)methyl)-2-(((1-oxo-2-propen-1-yl)oxy)methyl)-1,3-propanediyl) ester|2-Propenoic acid, 2-(((((3-((((2-ethylhexyl)oxy)carbonyl)amino)methylphenyl)amino)carbonyl)oxy)methyl)-2-(((1-oxo-2-propenyl)oxy)methyl)-1,3-propanediyl ester|[2-[[3-[(2-ethylhexoxycarbonylamino)methyl]phenyl]carbamoyloxymethyl]-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate|2-(((((3-((((2-Ethylhexyl)oxy)carbonyl)amino)methylphenyl)amino)carbonyl)oxy)methyl)-2-(((1-oxoallyl)oxy)methyl)-1,3-propanediyl diacrylate|2-Propenoic acid, 1,1'-[2-[[[[[3-[[[(2-ethylhexyl)oxy]carbonyl]amino]methylphenyl]amino]carbonyl]oxy]methyl]-2-[[(1-oxo-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester|EINECS 257-025-7|RefChem:89224
| Molecular Formula | C31H42N2O10 |
|---|---|
| Molecular Weight | 602.28 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 24 |
| Exact Mass | 602.28394 |
| Heavy Atoms | 43 |
| Complexity | 906.0 |
Chemical Identifiers
| CAS Number | 51160-59-9 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)NC1=C(C(=CC=C1)NC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C)C |
| InChIKey | NKNVNCKMHGFJHW-UHFFFAOYSA-N |
Product Overview
RefChem:89224 (CAS 51160-59-9), with molecular formula C31H42N2O10 and molecular weight 602.28 g/mol. IUPAC: [2-[[3-(2-ethylhexoxycarbonylamino)-2-methylphenyl]carbamoyloxymethyl]-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate.
Chemical Property Profile of RefChem:89224
Property Insights of RefChem:89224
The XLogP value of 6.1 indicates that RefChem:89224 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting RefChem:89224 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:89224 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:89224?
The CAS number of RefChem:89224 is 51160-59-9.
What is the molecular formula of RefChem:89224?
The molecular formula of RefChem:89224 is C31H42N2O10.
What is the molecular weight of RefChem:89224?
The molecular weight of RefChem:89224 is 602.28 g/mol.
Where can I buy RefChem:89224?
You can request a quote for RefChem:89224 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:89224?
Yes, KEHONG BIO provides custom synthesis services for RefChem:89224 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.