TL;DR: BAS 00278711 (CAS 324769-66-6) is a chemical compound with molecular formula C17H21Cl3N4O2 and molecular weight 418.073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]ethyl]butanamide
Also Known As: BAS 00278711, N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}butanamide, N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]ethyl]butanamide
| Molecular Formula | C17H21Cl3N4O2 |
| Molecular Weight | 418.073 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 64.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.073 Da |
| Heavy Atoms | 26 |
| Complexity | 571.0 |
| SMILES | CCCC(=O)NC(C(Cl)(Cl)Cl)NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C |
| InChIKey | INWJCRWBMKWZER-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that BAS 00278711 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00278711. Following Lipinski's Rule of Five, BAS 00278711 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 00278711 is 324769-66-6.
The molecular formula of BAS 00278711 is C17H21Cl3N4O2.
The molecular weight of BAS 00278711 is 418.073 g/mol.
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