![N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide structure](/static/products/5350/53501-40-9.webp)
N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide
TL;DR: N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide (CAS 53501-40-9) is a chemical compound with molecular formula C12H8ClN3O5S and molecular weight 340.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide
Also Known As: BAS 00286625, N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide, N-{3-chloro-2-hydroxy-5-nitrophenyl}-N'-(furan-2-ylcarbonyl)thiourea, 1-(3-Chloro-2-hydroxy-5-nitro-phenyl)-3-(furan-2-carbonyl)-thiourea, N-((3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl)furan-2-carboxamide
| Molecular Formula | C12H8ClN3O5S |
|---|---|
| Molecular Weight | 340.99 g/mol |
| LogP | 2.6736 |
| Topological Polar Surface Area | 117.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.9873 |
| Heavy Atoms | 22 |
| Complexity | 747.47003 |
Chemical Identifiers
| CAS Number | 53501-40-9 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)NC(=S)NC2=C(C(=CC(=C2)[N+](=O)[O-])Cl)O |
Product Overview
N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide (CAS 53501-40-9), with molecular formula C12H8ClN3O5S and molecular weight 340.99 g/mol. IUPAC: N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide
Property Insights of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide
The XLogP value of 2.6736 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide. The TPSA of 117.64 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide. Following Lipinski's Rule of Five, N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-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-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide?
The CAS number of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide is 53501-40-9.
What is the molecular formula of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide?
The molecular formula of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide is C12H8ClN3O5S.
What is the molecular weight of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide?
The molecular weight of N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide is 340.99 g/mol.
Where can I buy N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide?
You can request a quote for N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.