(2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
TL;DR: (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide (CAS 330580-22-8) is a chemical compound with molecular formula C14H11N3O5S and molecular weight 333.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
Also Known As: (E)-3-(furan-2-yl)-N-((2-hydroxy-4-nitrophenyl)carbamothioyl)acrylamide, (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide, (E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
| Molecular Formula | C14H11N3O5S |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 2.4198 |
| Topological Polar Surface Area | 117.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.04193 |
| Heavy Atoms | 23 |
| Complexity | 770.72485 |
Chemical Identifiers
| CAS Number | 330580-22-8 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
(2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide (CAS 330580-22-8), with molecular formula C14H11N3O5S and molecular weight 333.04 g/mol. IUPAC: (E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide.
Chemical Property Profile of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
Property Insights of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
The XLogP value of 2.4198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide. The TPSA of 117.64 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide. Following Lipinski's Rule of Five, (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide has 3 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 (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide?
The CAS number of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide is 330580-22-8.
What is the molecular formula of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide?
The molecular formula of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide is C14H11N3O5S.
What is the molecular weight of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide?
The molecular weight of (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide is 333.04 g/mol.
Where can I buy (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide?
You can request a quote for (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]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 (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(furan-2-yl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.