![1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea structure](/static/products/957/957505-03-2.png)
1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea
TL;DR: 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea (CAS 957505-03-2) is a chemical compound with molecular formula C13H13ClN6O4 and molecular weight 352.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chloro-1,3-dimethylpyrazole-5-carbonyl)amino]-3-(4-nitrophenyl)urea
Also Known As: 1-[(4-chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea, (4-chloro-1,3-dimethylpyrazol-5-yl)-N-{[(4-nitrophenyl)amino]carbonylamino}car boxamide, 2-[(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N-(4-nitrophenyl)hydrazinecarboxamide
| Molecular Formula | C13H13ClN6O4 |
|---|---|
| Molecular Weight | 352.07 g/mol |
| LogP | 1.75662 |
| Topological Polar Surface Area | 131.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.0687 |
| Heavy Atoms | 24 |
| Complexity | 801.5384 |
Chemical Identifiers
| CAS Number | 957505-03-2 |
|---|---|
| SMILES | CC1=NN(C(=C1Cl)C(=O)NNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C |
Product Overview
1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea (CAS 957505-03-2), with molecular formula C13H13ClN6O4 and molecular weight 352.07 g/mol. IUPAC: 1-[(4-chloro-1,3-dimethylpyrazole-5-carbonyl)amino]-3-(4-nitrophenyl)urea.
Chemical Property Profile of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea
Property Insights of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea
The XLogP value of 1.75662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea. The TPSA of 131.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea. Following Lipinski's Rule of Five, 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea 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-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea?
The CAS number of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea is 957505-03-2.
What is the molecular formula of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea?
The molecular formula of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea is C13H13ClN6O4.
What is the molecular weight of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea?
The molecular weight of 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea is 352.07 g/mol.
Where can I buy 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea?
You can request a quote for 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.