(E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
TL;DR: (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide (CAS 347319-78-2) is a chemical compound with molecular formula C17H15N3O3S and molecular weight 341.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
Also Known As: BIM-0007171.P001, (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide, (2E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
| Molecular Formula | C17H15N3O3S |
|---|---|
| Molecular Weight | 341.08 g/mol |
| LogP | 3.42962 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.0834 |
| Heavy Atoms | 24 |
| Complexity | 803.983 |
Chemical Identifiers
| CAS Number | 347319-78-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)/C=C/C2=CC=CC=C2 |
Product Overview
(E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide (CAS 347319-78-2), with molecular formula C17H15N3O3S and molecular weight 341.08 g/mol. IUPAC: (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide.
Chemical Property Profile of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
Property Insights of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
The XLogP value of 3.42962 indicates that (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide. Following Lipinski's Rule of Five, (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide 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 (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
The CAS number of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is 347319-78-2.
What is the molecular formula of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
The molecular formula of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is C17H15N3O3S.
What is the molecular weight of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
The molecular weight of (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide is 341.08 g/mol.
Where can I buy (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
You can request a quote for (E)-N-[(2-methyl-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 (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.