![({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione structure](/static/products/384/384369-59-9.png)
({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione
TL;DR: ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione (CAS 384369-59-9) is a chemical compound with molecular formula C22H22N6O3S and molecular weight 450.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]methylideneamino]-3-prop-2-enylthiourea
Also Known As: ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione, (2E)-2-{[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide, (E)-N-allyl-2-((3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)hydrazinecarbothioamide, 1-[(E)-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]methylideneamino]-3-prop-2-enylthiourea
| Molecular Formula | C22H22N6O3S |
|---|---|
| Molecular Weight | 450.15 g/mol |
| LogP | 3.8302 |
| Topological Polar Surface Area | 106.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.1474 |
| Heavy Atoms | 32 |
| Complexity | 1143.8229 |
Chemical Identifiers
| CAS Number | 384369-59-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=N/NC(=S)NCC=C)C3=CC=CC=C3)[N+](=O)[O-] |
Product Overview
({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione (CAS 384369-59-9), with molecular formula C22H22N6O3S and molecular weight 450.15 g/mol. IUPAC: 1-[(E)-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]methylideneamino]-3-prop-2-enylthiourea.
Chemical Property Profile of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione
Property Insights of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione
The XLogP value of 3.8302 indicates that ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.61 Ų falls within the moderate polarity range, balancing permeability and solubility for ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione. Following Lipinski's Rule of Five, ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione has 2 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 ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione?
The CAS number of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione is 384369-59-9.
What is the molecular formula of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione?
The molecular formula of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione is C22H22N6O3S.
What is the molecular weight of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione?
The molecular weight of ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione is 450.15 g/mol.
Where can I buy ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione?
You can request a quote for ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for ({(1E)-2-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-1-azavinyl}amino)(p rop-2-enylamino)methane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.