BAS 01058941
TL;DR: BAS 01058941 (CAS 313396-38-2) is a chemical compound with molecular formula C16H12ClF3N4O3 and molecular weight 400.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 01058941, BIM-0034548.P001, 3-chloro-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, AB00098391-01, 5-(3,4-dimethoxyphenyl)-3-chloro-7-(trifluoromethyl)-8-hydropyrazolo[1,5-a]pyr imidine-2-carboxamide
| Molecular Formula | C16H12ClF3N4O3 |
|---|---|
| Molecular Weight | 400.06 g/mol |
| LogP | 3.1846 |
| Topological Polar Surface Area | 91.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.055 |
| Heavy Atoms | 27 |
| Complexity | 1049.547 |
Chemical Identifiers
| CAS Number | 313396-38-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)N)Cl)OC |
Product Overview
BAS 01058941 (CAS 313396-38-2), with molecular formula C16H12ClF3N4O3 and molecular weight 400.06 g/mol. IUPAC: 3-chloro-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 01058941
Property Insights of BAS 01058941
The XLogP value of 3.1846 indicates that BAS 01058941 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01058941. Following Lipinski's Rule of Five, BAS 01058941 has 1 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 BAS 01058941?
The CAS number of BAS 01058941 is 313396-38-2.
What is the molecular formula of BAS 01058941?
The molecular formula of BAS 01058941 is C16H12ClF3N4O3.
What is the molecular weight of BAS 01058941?
The molecular weight of BAS 01058941 is 400.06 g/mol.
Where can I buy BAS 01058941?
You can request a quote for BAS 01058941 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01058941?
Yes, KEHONG BIO provides custom synthesis services for BAS 01058941 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.