TL;DR: BAS 06057607 (CAS 132784-29-3) is a chemical compound with molecular formula C16H15N3O3S and molecular weight 329.0834 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-amino-3-(2-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate
Also Known As: BAS 06057607, ethyl 5-amino-3-(2-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate, 5-amino-3-(2-methylphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester, AH-153/31146048, Ethyl 5-amino-4-oxo-3-(o-tolyl)-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
| Molecular Formula | C16H15N3O3S |
| Molecular Weight | 329.0834 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.0834 Da |
| Heavy Atoms | 23 |
| Complexity | 525.0 |
| SMILES | CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)N)C3=CC=CC=C3C |
| InChIKey | SXGQRQVITZAZLR-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that BAS 06057607 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06057607. Following Lipinski's Rule of Five, BAS 06057607 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 06057607 is 132784-29-3.
The molecular formula of BAS 06057607 is C16H15N3O3S.
The molecular weight of BAS 06057607 is 329.0834 g/mol.
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