A0435/0020136
TL;DR: A0435/0020136 (CAS 322756-31-0) is a chemical compound with molecular formula C19H24N2O11 and molecular weight 456.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a-O,5-O-diethyl 2-O-methyl 4-(3-ethoxycarbonyl-1,2-oxazol-4-yl)-2,3,4,5-tetrahydro-[1,2]oxazolo[2,3-b][1,2]oxazole-2,3a,5-tricarboxylate
Also Known As: A0435/0020136, 3a-O,5-O-diethyl 2-O-methyl 4-(3-ethoxycarbonyl-1,2-oxazol-4-yl)-2,3,4,5-tetrahydro-[1,2]oxazolo[2,3-b][1,2]oxazole-2,3a,5-tricarboxylate, 2,3a-diethyl 5-methyl 3-(3-(ethoxycarbonyl)isoxazol-4-yl)tetrahydro-2H-isoxazolo[2,3-b]isoxazole-2,3a,5-tricarboxylate, 2,3a-diethyl 5-methyl 3-[3-(ethoxycarbonyl)-1,2-oxazol-4-yl]tetrahydro-3aH-[1,2]oxazolo[2,3-b][1,2]oxazole-2,3a,5-tricarboxylate, ethyl 2-(ethoxycarbonyl)-3-[3-(ethoxycarbonyl)isoxazol-4-yl]-5-(methoxycarbony l)-2H,3H,4H,5H-1,2-oxazolidino[2,3-b]1,2-oxazolidin-3a-carboxylate
| Molecular Formula | C19H24N2O11 |
|---|---|
| Molecular Weight | 456.14 g/mol |
| LogP | 0.2926 |
| Topological Polar Surface Area | 152.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.138 |
| Heavy Atoms | 32 |
| Complexity | 884.3799 |
Chemical Identifiers
| CAS Number | 322756-31-0 |
|---|---|
| SMILES | CCOC(=O)C1C(C2(CC(ON2O1)C(=O)OC)C(=O)OCC)C3=CON=C3C(=O)OCC |
Product Overview
A0435/0020136 (CAS 322756-31-0), with molecular formula C19H24N2O11 and molecular weight 456.14 g/mol. IUPAC: 3a-O,5-O-diethyl 2-O-methyl 4-(3-ethoxycarbonyl-1,2-oxazol-4-yl)-2,3,4,5-tetrahydro-[1,2]oxazolo[2,3-b][1,2]oxazole-2,3a,5-tricarboxylate.
Chemical Property Profile of A0435/0020136
Property Insights of A0435/0020136
The XLogP value of 0.2926 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A0435/0020136. The TPSA of 152.93 Ų indicates high polarity, suggesting A0435/0020136 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A0435/0020136 has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A0435/0020136?
The CAS number of A0435/0020136 is 322756-31-0.
What is the molecular formula of A0435/0020136?
The molecular formula of A0435/0020136 is C19H24N2O11.
What is the molecular weight of A0435/0020136?
The molecular weight of A0435/0020136 is 456.14 g/mol.
Where can I buy A0435/0020136?
You can request a quote for A0435/0020136 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0435/0020136?
Yes, KEHONG BIO provides custom synthesis services for A0435/0020136 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.