![5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide structure](/static/products/5158/515874-36-9.webp)
5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide
TL;DR: 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide (CAS 515874-36-9) is a chemical compound with molecular formula C18H16ClN5O5S and molecular weight 449.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide
Also Known As: 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide, 5-[(4-chloro-1H-pyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide, N-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}-N'-{4-ethoxy-2-nitrophenyl}thiourea, N-({5-[(4-CHLORO-1H-PYRAZOL-1-YL)METHYL]-2-FURYL}CARBONYL)-N'-(4-ETHOXY-2-NITROPHENYL)THIOUREA
| Molecular Formula | C18H16ClN5O5S |
|---|---|
| Molecular Weight | 449.06 g/mol |
| LogP | 3.6115 |
| Topological Polar Surface Area | 124.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.05606 |
| Heavy Atoms | 30 |
| Complexity | 1096.3351 |
Chemical Identifiers
| CAS Number | 515874-36-9 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl)[N+](=O)[O-] |
Product Overview
5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide (CAS 515874-36-9), with molecular formula C18H16ClN5O5S and molecular weight 449.06 g/mol. IUPAC: 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide
Property Insights of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide
The XLogP value of 3.6115 indicates that 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide. Following Lipinski's Rule of Five, 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide has 2 hydrogen bond donor(s) and 7 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 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide?
The CAS number of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide is 515874-36-9.
What is the molecular formula of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide?
The molecular formula of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide is C18H16ClN5O5S.
What is the molecular weight of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide?
The molecular weight of 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide is 449.06 g/mol.
Where can I buy 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide?
You can request a quote for 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-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 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.