BAS 00481808
TL;DR: BAS 00481808 (CAS 313247-32-4) is a chemical compound with molecular formula C20H13Cl2F3N4O3S and molecular weight 516.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 00481808, 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, F0452-5569, 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C20H13Cl2F3N4O3S |
|---|---|
| Molecular Weight | 516.00 g/mol |
| LogP | 6.0529 |
| Topological Polar Surface Area | 77.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 516.0037 |
| Heavy Atoms | 33 |
| Complexity | 1357.3363 |
Chemical Identifiers
| CAS Number | 313247-32-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1NC(=O)C2=NN3C(=CC(=NC3=C2Cl)C4=CC=CS4)C(F)(F)F)OC)Cl |
Product Overview
BAS 00481808 (CAS 313247-32-4), with molecular formula C20H13Cl2F3N4O3S and molecular weight 516.00 g/mol. IUPAC: 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 00481808
Property Insights of BAS 00481808
The XLogP value of 6.0529 indicates that BAS 00481808 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00481808. Following Lipinski's Rule of Five, BAS 00481808 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00481808?
The CAS number of BAS 00481808 is 313247-32-4.
What is the molecular formula of BAS 00481808?
The molecular formula of BAS 00481808 is C20H13Cl2F3N4O3S.
What is the molecular weight of BAS 00481808?
The molecular weight of BAS 00481808 is 516.00 g/mol.
Where can I buy BAS 00481808?
You can request a quote for BAS 00481808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00481808?
Yes, KEHONG BIO provides custom synthesis services for BAS 00481808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.