![(E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide structure](/static/products/4284/428495-73-2.webp)
(E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide
TL;DR: (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide (CAS 428495-73-2) is a chemical compound with molecular formula C18H17ClN4O4S and molecular weight 420.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide
Also Known As: (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide, (2E)-N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-3-(furan-2-yl)prop-2-enamide, N-[4-(2-chloro-4-nitro-phenyl)piperazine-1-carbothioyl]-3-(2-furyl)prop-2-enamide
| Molecular Formula | C18H17ClN4O4S |
|---|---|
| Molecular Weight | 420.07 g/mol |
| LogP | 3.0777 |
| Topological Polar Surface Area | 91.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.06592 |
| Heavy Atoms | 28 |
| Complexity | 908.31433 |
Chemical Identifiers
| CAS Number | 428495-73-2 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=S)NC(=O)/C=C/C3=CC=CO3 |
Product Overview
(E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide (CAS 428495-73-2), with molecular formula C18H17ClN4O4S and molecular weight 420.07 g/mol. IUPAC: (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide.
Chemical Property Profile of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide
Property Insights of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide
The XLogP value of 3.0777 indicates that (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 6 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 (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide?
The CAS number of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide is 428495-73-2.
What is the molecular formula of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide?
The molecular formula of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide is C18H17ClN4O4S.
What is the molecular weight of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide?
The molecular weight of (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide is 420.07 g/mol.
Where can I buy (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide?
You can request a quote for (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-3-(furan-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.