N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide
TL;DR: N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide (CAS 438463-49-1) is a chemical compound with molecular formula C18H18N4O4 and molecular weight 354.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-nitrophenyl)-N'-[(E)-4-phenylbutan-2-ylideneamino]oxamide
Also Known As: N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide, N-(3-nitrophenyl)-N'-[(E)-4-phenylbutan-2-ylideneamino]oxamide
| Molecular Formula | C18H18N4O4 |
|---|---|
| Molecular Weight | 354.13 g/mol |
| LogP | 2.6582 |
| Topological Polar Surface Area | 113.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.1328 |
| Heavy Atoms | 26 |
| Complexity | 834.09454 |
Chemical Identifiers
| CAS Number | 438463-49-1 |
|---|---|
| SMILES | C/C(=N\NC(=O)C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])/CCC2=CC=CC=C2 |
Product Overview
N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide (CAS 438463-49-1), with molecular formula C18H18N4O4 and molecular weight 354.13 g/mol. IUPAC: N-(3-nitrophenyl)-N'-[(E)-4-phenylbutan-2-ylideneamino]oxamide.
Chemical Property Profile of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide
Property Insights of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide
The XLogP value of 2.6582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide. The TPSA of 113.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide. Following Lipinski's Rule of Five, N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide has 2 hydrogen bond donor(s) and 5 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 N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide?
The CAS number of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide is 438463-49-1.
What is the molecular formula of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide?
The molecular formula of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide is C18H18N4O4.
What is the molecular weight of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide?
The molecular weight of N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide is 354.13 g/mol.
Where can I buy N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide?
You can request a quote for N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-nitrophenyl)-N'-(4-phenylbutan-2-ylideneamino)oxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.