TL;DR: BAS 01859531 (CAS 1310341-84-4) is a chemical compound with molecular formula C15H10ClFN4OS and molecular weight 348.02478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(5-chlorothiophen-2-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]-1H-pyrazole-3-carboxamide
Also Known As: BAS 01859531, 3-(5-chlorothiophen-2-yl)-N'-[(E)-(4-fluorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide, (E)-3-(5-chlorothiophen-2-yl)-N'-(4-fluorobenzylidene)-1H-pyrazole-5-carbohydrazide, 3-(5-CHLORO-2-THIENYL)-N'-(4-FLUOROBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE, N-[(1E)-2-(4-fluorophenyl)-1-azavinyl][3-(5-chloro(2-thienyl))pyrazol-5-yl]car boxamide
| Molecular Formula | C15H10ClFN4OS |
| Molecular Weight | 348.02478 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 98.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.02478 Da |
| Heavy Atoms | 23 |
| Complexity | 447.0 |
| SMILES | C1=CC(=CC=C1/C=N/NC(=O)C2=NNC(=C2)C3=CC=C(S3)Cl)F |
| InChIKey | KNTGNPOEVPVMEC-QGMBQPNBSA-N |
The XLogP value of 3.9 indicates that BAS 01859531 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01859531. Following Lipinski's Rule of Five, BAS 01859531 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 01859531 is 1310341-84-4.
The molecular formula of BAS 01859531 is C15H10ClFN4OS.
The molecular weight of BAS 01859531 is 348.02478 g/mol.
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