BAS 00481828
TL;DR: BAS 00481828 (CAS 309940-76-9) is a chemical compound with molecular formula C23H12ClF3N6O4S and molecular weight 560.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(3-nitro-5-pyridin-3-yloxyphenyl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 00481828, 3-chloro-N-(3-nitro-5-pyridin-3-yloxyphenyl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-[3-nitro-5-(3-pyridinyloxy)phenyl]-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-CHLORO-N-[3-NITRO-5-(PYRIDIN-3-YLOXY)PHENYL]-5-(THIOPHEN-2-YL)-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXAMIDE
| Molecular Formula | C23H12ClF3N6O4S |
|---|---|
| Molecular Weight | 560.03 g/mol |
| LogP | 6.4778 |
| Topological Polar Surface Area | 124.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 560.02814 |
| Heavy Atoms | 38 |
| Complexity | 1676.5596 |
Chemical Identifiers
| CAS Number | 309940-76-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN4C(=CC(=NC4=C3Cl)C5=CC=CS5)C(F)(F)F |
Product Overview
BAS 00481828 (CAS 309940-76-9), with molecular formula C23H12ClF3N6O4S and molecular weight 560.03 g/mol. IUPAC: 3-chloro-N-(3-nitro-5-pyridin-3-yloxyphenyl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 00481828
Property Insights of BAS 00481828
The XLogP value of 6.4778 indicates that BAS 00481828 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.55 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00481828. Following Lipinski's Rule of Five, BAS 00481828 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00481828?
The CAS number of BAS 00481828 is 309940-76-9.
What is the molecular formula of BAS 00481828?
The molecular formula of BAS 00481828 is C23H12ClF3N6O4S.
What is the molecular weight of BAS 00481828?
The molecular weight of BAS 00481828 is 560.03 g/mol.
Where can I buy BAS 00481828?
You can request a quote for BAS 00481828 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00481828?
Yes, KEHONG BIO provides custom synthesis services for BAS 00481828 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.