BAS 01058413
TL;DR: BAS 01058413 (CAS 5815-53-2) is a chemical compound with molecular formula C15H14Cl2F3N3O3 and molecular weight 411.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide
Also Known As: BAS 01058413, BIM-0034379.P001, N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide, N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide, N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetamide
| Molecular Formula | C15H14Cl2F3N3O3 |
|---|---|
| Molecular Weight | 411.04 g/mol |
| LogP | 4.17302 |
| Topological Polar Surface Area | 65.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.03644 |
| Heavy Atoms | 26 |
| Complexity | 837.76483 |
Chemical Identifiers
| CAS Number | 5815-53-2 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CC(=C(C=C2OC)Cl)OC)C(F)(F)F)Cl |
Product Overview
BAS 01058413 (CAS 5815-53-2), with molecular formula C15H14Cl2F3N3O3 and molecular weight 411.04 g/mol. IUPAC: N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide.
Chemical Property Profile of BAS 01058413
Property Insights of BAS 01058413
The XLogP value of 4.17302 indicates that BAS 01058413 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.38 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01058413. Following Lipinski's Rule of Five, BAS 01058413 has 1 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 BAS 01058413?
The CAS number of BAS 01058413 is 5815-53-2.
What is the molecular formula of BAS 01058413?
The molecular formula of BAS 01058413 is C15H14Cl2F3N3O3.
What is the molecular weight of BAS 01058413?
The molecular weight of BAS 01058413 is 411.04 g/mol.
Where can I buy BAS 01058413?
You can request a quote for BAS 01058413 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01058413?
Yes, KEHONG BIO provides custom synthesis services for BAS 01058413 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.