diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate
TL;DR: diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate (CAS 799782-74-4) is a chemical compound with molecular formula C19H25N3O8 and molecular weight 423.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-ethyl-2-[3-[2-(3-nitrobenzoyl)hydrazinyl]-3-oxopropyl]propanedioate
Also Known As: diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate, Diethyl 2-ethyl-2-[2-[[(3-nitrobenzoyl)amino]carbamoyl]ethyl]propanedioate, diethyl 2-ethyl-2-[3-[2-(3-nitrobenzoyl)hydrazinyl]-3-oxopropyl]propanedioate, diethyl ethyl(3-{2-[(3-nitrophenyl)carbonyl]hydrazinyl}-3-oxopropyl)propanedioate
| Molecular Formula | C19H25N3O8 |
|---|---|
| Molecular Weight | 423.16 g/mol |
| LogP | 1.6586 |
| Topological Polar Surface Area | 153.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 423.16415 |
| Heavy Atoms | 30 |
| Complexity | 790.7242 |
Chemical Identifiers
| CAS Number | 799782-74-4 |
|---|---|
| SMILES | CCC(CCC(=O)NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])(C(=O)OCC)C(=O)OCC |
Product Overview
diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate (CAS 799782-74-4), with molecular formula C19H25N3O8 and molecular weight 423.16 g/mol. IUPAC: diethyl 2-ethyl-2-[3-[2-(3-nitrobenzoyl)hydrazinyl]-3-oxopropyl]propanedioate.
Chemical Property Profile of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate
Property Insights of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate
The XLogP value of 1.6586 suggests moderate lipophilicity, balancing water solubility and membrane permeability for diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate. The TPSA of 153.94 Ų indicates high polarity, suggesting diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate?
The CAS number of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate is 799782-74-4.
What is the molecular formula of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate?
The molecular formula of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate is C19H25N3O8.
What is the molecular weight of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate?
The molecular weight of diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate is 423.16 g/mol.
Where can I buy diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate?
You can request a quote for diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 2-ethyl-2-(3-(2-(3-nitrobenzoyl)hydrazinyl)-3-oxopropyl)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.