N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide
TL;DR: N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide (CAS 90124-96-2) is a chemical compound with molecular formula C25H23N3O4 and molecular weight 429.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-3-(3,4-dimethylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Also Known As: BAS 00355059, N-(1-((3,4-DIMETHYLANILINO)CARBONYL)-2-(3-NITROPHENYL)VINYL)-4-METHYLBENZAMIDE, N-[(Z)-3-(3,4-dimethylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide, N-[1-{[(3,4-dimethylphenyl)amino]carbonyl}-2-(3-nitrophenyl)vinyl]-4-methylbenzamide, 651-628-2
| Molecular Formula | C25H23N3O4 |
|---|---|
| Molecular Weight | 429.17 g/mol |
| LogP | 4.92966 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.16885 |
| Heavy Atoms | 32 |
| Complexity | 1214.1116 |
Chemical Identifiers
| CAS Number | 90124-96-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NC3=CC(=C(C=C3)C)C |
Product Overview
N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide (CAS 90124-96-2), with molecular formula C25H23N3O4 and molecular weight 429.17 g/mol. IUPAC: N-[(Z)-3-(3,4-dimethylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide.
Chemical Property Profile of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide
Property Insights of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide
The XLogP value of 4.92966 indicates that N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide. Following Lipinski's Rule of Five, N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide 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 N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide?
The CAS number of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide is 90124-96-2.
What is the molecular formula of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide?
The molecular formula of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide is C25H23N3O4.
What is the molecular weight of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide?
The molecular weight of N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide is 429.17 g/mol.
Where can I buy N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide?
You can request a quote for N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-((3,4-Dimethylanilino)carbonyl)-2-(3-nitrophenyl)vinyl)-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.