![(2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide structure](/static/products/413/413580-35-5.png)
(2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
TL;DR: (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide (CAS 413580-35-5) is a chemical compound with molecular formula C16H13N3O4S and molecular weight 343.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
Also Known As: N-((2-hydroxy-4-nitrophenyl)carbamothioyl)cinnamamide, (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide, (E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
| Molecular Formula | C16H13N3O4S |
|---|---|
| Molecular Weight | 343.06 g/mol |
| LogP | 2.8268 |
| Topological Polar Surface Area | 104.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.06268 |
| Heavy Atoms | 24 |
| Complexity | 806.22473 |
Chemical Identifiers
| CAS Number | 413580-35-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
(2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide (CAS 413580-35-5), with molecular formula C16H13N3O4S and molecular weight 343.06 g/mol. IUPAC: (E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide.
Chemical Property Profile of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
Property Insights of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
The XLogP value of 2.8268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide. The TPSA of 104.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide. Following Lipinski's Rule of Five, (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide has 3 hydrogen bond donor(s) and 5 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)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
The CAS number of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is 413580-35-5.
What is the molecular formula of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
The molecular formula of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is C16H13N3O4S.
What is the molecular weight of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
The molecular weight of (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is 343.06 g/mol.
Where can I buy (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
You can request a quote for (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-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)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.