T0511-3166
TL;DR: T0511-3166 (CAS 5354-48-3) is a chemical compound with molecular formula C13H12ClN3O3 and molecular weight 293.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone
Also Known As: 1-(2-chlorophenyl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethanone, 1-(2-chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone, 1-(2-chlorophenyl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethan-1-one, RefChem:382791
| Molecular Formula | C13H12ClN3O3 |
|---|---|
| Molecular Weight | 293.06 g/mol |
| LogP | 2.94444 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.05673 |
| Heavy Atoms | 20 |
| Complexity | 694.165 |
Chemical Identifiers
| CAS Number | 5354-48-3 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)C2=CC=CC=C2Cl)C)[N+](=O)[O-] |
Product Overview
T0511-3166 (CAS 5354-48-3), with molecular formula C13H12ClN3O3 and molecular weight 293.06 g/mol. IUPAC: 1-(2-chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone.
Chemical Property Profile of T0511-3166
Property Insights of T0511-3166
The XLogP value of 2.94444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for T0511-3166. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for T0511-3166. Following Lipinski's Rule of Five, T0511-3166 has 0 hydrogen bond donor(s) and 4 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 T0511-3166?
The CAS number of T0511-3166 is 5354-48-3.
What is the molecular formula of T0511-3166?
The molecular formula of T0511-3166 is C13H12ClN3O3.
What is the molecular weight of T0511-3166?
The molecular weight of T0511-3166 is 293.06 g/mol.
Where can I buy T0511-3166?
You can request a quote for T0511-3166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for T0511-3166?
Yes, KEHONG BIO provides custom synthesis services for T0511-3166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.