(E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide
TL;DR: (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide (CAS 1321950-48-4) is a chemical compound with molecular formula C21H18N2O3S and molecular weight 378.10382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)prop-2-enamide
Also Known As: (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide, (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)prop-2-enamide, (2E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)prop-2-enamide, N,N-Dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide, F0447-0085
Technical Specifications
| Molecular Formula | C21H18N2O3S |
| Molecular Weight | 378.10382 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 94.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.10382 Da |
| Heavy Atoms | 27 |
| Complexity | 502.0 |
| SMILES | C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)/C=C/C3=CC=C(S3)[N+](=O)[O-] |
| InChIKey | HPSUJWVBNVXWKL-ACCUITESSA-N |
Chemical Property Profile of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide
Property Insights of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide
The XLogP value of 4.7 indicates that (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide. Following Lipinski's Rule of Five, (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide?
The CAS number of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide is 1321950-48-4.
What is the molecular formula of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide?
The molecular formula of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide is C21H18N2O3S.
What is the molecular weight of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide?
The molecular weight of (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide is 378.10382 g/mol.
Where can I buy (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide?
You can request a quote for (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide?
Yes, CoreyChem provides custom synthesis services for (E)-N,N-dibenzyl-3-(5-nitrothiophen-2-yl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.