![4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide structure](/static/products/3333/333398-35-9.webp)
4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide
TL;DR: 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide (CAS 333398-35-9) is a chemical compound with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide
Also Known As: 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide, BIM-0000294.P001, 4-methyl-N-{2-[(4-nitrophenyl)amino]ethyl}benzamide, N-(2-{4-nitroanilino}ethyl)-4-methylbenzamide, A1339/0060440
| Molecular Formula | C16H17N3O3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 2.74512 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.12698 |
| Heavy Atoms | 22 |
| Complexity | 651.3412 |
Chemical Identifiers
| CAS Number | 333398-35-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide (CAS 333398-35-9), with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol. IUPAC: 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide.
Chemical Property Profile of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide
Property Insights of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide
The XLogP value of 2.74512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide. Following Lipinski's Rule of Five, 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide has 2 hydrogen bond donor(s) and 4 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 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide?
The CAS number of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide is 333398-35-9.
What is the molecular formula of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide?
The molecular formula of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide is C16H17N3O3.
What is the molecular weight of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide?
The molecular weight of 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide is 299.13 g/mol.
Where can I buy 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide?
You can request a quote for 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-[2-(4-nitroanilino)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.