![1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea structure](/static/products/5128/512824-82-7.webp)
1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea
TL;DR: 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea (CAS 512824-82-7) is a chemical compound with molecular formula C14H16N6O3S and molecular weight 348.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea
Also Known As: 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea, 2-({3-nitro-5-methyl-1H-pyrazol-1-yl}acetyl)-N-(4-methylphenyl)hydrazinecarbothioamide, 2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]-N-(4-methylphenyl)hydrazinecarbothioamide, 2-[2-(5-METHYL-3-NITRO-1H-PYRAZOL-1-YL)ACETYL]-N-(4-METHYLPHENYL)-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C14H16N6O3S |
|---|---|
| Molecular Weight | 348.10 g/mol |
| LogP | 1.42594 |
| Topological Polar Surface Area | 114.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.10046 |
| Heavy Atoms | 24 |
| Complexity | 771.317 |
Chemical Identifiers
| CAS Number | 512824-82-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NNC(=O)CN2C(=CC(=N2)[N+](=O)[O-])C |
Product Overview
1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea (CAS 512824-82-7), with molecular formula C14H16N6O3S and molecular weight 348.10 g/mol. IUPAC: 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea.
Chemical Property Profile of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea
Property Insights of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea
The XLogP value of 1.42594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea. The TPSA of 114.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea. Following Lipinski's Rule of Five, 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)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-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea?
The CAS number of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea is 512824-82-7.
What is the molecular formula of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea?
The molecular formula of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea is C14H16N6O3S.
What is the molecular weight of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea?
The molecular weight of 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea is 348.10 g/mol.
Where can I buy 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea?
You can request a quote for 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-3-(4-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.