![1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea structure](/static/products/957/957490-96-9.png)
1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea
TL;DR: 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea (CAS 957490-96-9) is a chemical compound with molecular formula C14H16N6O4S and molecular weight 364.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1,3-dimethyl-4-nitropyrazole-5-carbonyl)amino]-3-(4-methoxyphenyl)thiourea
Also Known As: 1-[(2,5-dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea, 2-({4-nitro-1,3-dimethyl-1H-pyrazol-5-yl}carbonyl)-N-(4-methoxyphenyl)hydrazinecarbothioamide, 2-[(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)CARBONYL]-N-(4-METHOXYPHENYL)-1-HYDRAZINECARBOTHIOAMIDE, 2-[(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)carbonyl]-N-(4-methoxyphenyl)hydrazinecarbothioamide
| Molecular Formula | C14H16N6O4S |
|---|---|
| Molecular Weight | 364.10 g/mol |
| LogP | 1.27672 |
| Topological Polar Surface Area | 123.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.09537 |
| Heavy Atoms | 25 |
| Complexity | 817.4746 |
Chemical Identifiers
| CAS Number | 957490-96-9 |
|---|---|
| SMILES | CC1=NN(C(=C1[N+](=O)[O-])C(=O)NNC(=S)NC2=CC=C(C=C2)OC)C |
Product Overview
1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea (CAS 957490-96-9), with molecular formula C14H16N6O4S and molecular weight 364.10 g/mol. IUPAC: 1-[(1,3-dimethyl-4-nitropyrazole-5-carbonyl)amino]-3-(4-methoxyphenyl)thiourea.
Chemical Property Profile of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea
Property Insights of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea
The XLogP value of 1.27672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea. The TPSA of 123.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea. Following Lipinski's Rule of Five, 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea 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 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea?
The CAS number of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea is 957490-96-9.
What is the molecular formula of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea?
The molecular formula of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea is C14H16N6O4S.
What is the molecular weight of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea?
The molecular weight of 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea is 364.10 g/mol.
Where can I buy 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea?
You can request a quote for 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)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-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2,5-Dimethyl-4-nitropyrazole-3-carbonyl)amino]-3-(4-methoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.