TL;DR: BAS 00924508 (CAS 333765-12-1) is a chemical compound with molecular formula C18H16F3N5O3 and molecular weight 407.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-tert-butyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 00924508, N-tert-butyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(tert-butyl)-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(tert-butyl)[5-(4-nitrophenyl)-7-(trifluoromethyl)(8-hydropyrazolo[1,5-a]pyr imidin-2-yl)]carboxamide
| Molecular Formula | C18H16F3N5O3 |
| Molecular Weight | 407.1205 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.1205 Da |
| Heavy Atoms | 29 |
| Complexity | 626.0 |
| SMILES | CC(C)(C)NC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F |
| InChIKey | IGEUBSOGJPKUGJ-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that BAS 00924508 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00924508. Following Lipinski's Rule of Five, BAS 00924508 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 00924508 is 333765-12-1.
The molecular formula of BAS 00924508 is C18H16F3N5O3.
The molecular weight of BAS 00924508 is 407.1205 g/mol.
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