![1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea structure](/static/products/5128/512824-76-9.webp)
1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea
TL;DR: 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea (CAS 512824-76-9) is a chemical compound with molecular formula C13H13ClN6O3S and molecular weight 368.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea
Also Known As: 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea, N-(4-chlorophenyl)-2-({3-nitro-5-methyl-1H-pyrazol-1-yl}acetyl)hydrazinecarbothioamide, N-(4-chlorophenyl)-2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]hydrazinecarbothioamide, N-(4-CHLOROPHENYL)-2-[2-(5-METHYL-3-NITRO-1H-PYRAZOL-1-YL)ACETYL]-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C13H13ClN6O3S |
|---|---|
| Molecular Weight | 368.05 g/mol |
| LogP | 1.77092 |
| Topological Polar Surface Area | 114.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.04584 |
| Heavy Atoms | 24 |
| Complexity | 776.5143 |
Chemical Identifiers
| CAS Number | 512824-76-9 |
|---|---|
| SMILES | CC1=CC(=NN1CC(=O)NNC(=S)NC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea (CAS 512824-76-9), with molecular formula C13H13ClN6O3S and molecular weight 368.05 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea.
Chemical Property Profile of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea
Property Insights of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea
The XLogP value of 1.77092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea. The TPSA of 114.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea. Following Lipinski's Rule of Five, 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea has 3 hydrogen bond donor(s) and 5 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 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea?
The CAS number of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea is 512824-76-9.
What is the molecular formula of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea?
The molecular formula of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea is C13H13ClN6O3S.
What is the molecular weight of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea?
The molecular weight of 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea is 368.05 g/mol.
Where can I buy 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea?
You can request a quote for 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-chlorophenyl)-3-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.