(2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate
TL;DR: (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate (CAS 1211687-49-8) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.13248 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate
Also Known As: (2-amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate
Technical Specifications
| Molecular Formula | C15H19N3O5 |
| Molecular Weight | 321.13248 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.13248 Da |
| Heavy Atoms | 23 |
| Complexity | 457.0 |
| SMILES | CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)N |
| InChIKey | FVLALAITVJMMDW-UHFFFAOYSA-N |
Chemical Property Profile of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate
Property Insights of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate. Following Lipinski's Rule of Five, (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate?
The CAS number of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate is 1211687-49-8.
What is the molecular formula of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate?
The molecular formula of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate is C15H19N3O5.
What is the molecular weight of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate?
The molecular weight of (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate is 321.13248 g/mol.
Where can I buy (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate?
You can request a quote for (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate?
Yes, CoreyChem provides custom synthesis services for (2-Amino-2-oxoethyl) 2-(4-methylpiperidin-1-yl)-5-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.