![N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide structure](/static/products/330/330580-23-9.png)
N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide
TL;DR: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide (CAS 330580-23-9) is a chemical compound with molecular formula C13H10N4O4S and molecular weight 318.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide
Also Known As: N-((2-hydroxy-4-nitrophenyl)carbamothioyl)nicotinamide, N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide
| Molecular Formula | C13H10N4O4S |
|---|---|
| Molecular Weight | 318.04 g/mol |
| LogP | 1.8222 |
| Topological Polar Surface Area | 117.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.04227 |
| Heavy Atoms | 22 |
| Complexity | 736.0749 |
Chemical Identifiers
| CAS Number | 330580-23-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide (CAS 330580-23-9), with molecular formula C13H10N4O4S and molecular weight 318.04 g/mol. IUPAC: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide.
Chemical Property Profile of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide
Property Insights of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide
The XLogP value of 1.8222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide. The TPSA of 117.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide. Following Lipinski's Rule of Five, N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide 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 N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide?
The CAS number of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide is 330580-23-9.
What is the molecular formula of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide?
The molecular formula of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide is C13H10N4O4S.
What is the molecular weight of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide?
The molecular weight of N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide is 318.04 g/mol.
Where can I buy N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide?
You can request a quote for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.