TL;DR: BAS 01118134 (CAS 332101-85-6) is a chemical compound with molecular formula C15H15N3O and molecular weight 253.1215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-methyl-4-prop-2-enylpyrazolo[1,5-a]benzimidazol-3-yl)ethanone
Also Known As: BAS 01118134, 1-[4-Methyl-7-(prop-2-en-1-yl)-2,3,7-triazatricyclo[6.4.0.0,2,6]dodeca-1(12),3,5,8,10-pentaen-5-yl]ethan-1-one, 1-(4-allyl-2-methyl-4H-pyrazolo[1,5-a]benzimidazol-3-yl)ethanone, AB00092272-01, 1-(2-methyl-4-prop-2-enylpyrazolo[1,5-a]benzimidazol-3-yl)ethanone
| Molecular Formula | C15H15N3O |
| Molecular Weight | 253.1215 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 39.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.1215 Da |
| Heavy Atoms | 19 |
| Complexity | 384.0 |
| SMILES | CC1=NN2C3=CC=CC=C3N(C2=C1C(=O)C)CC=C |
| InChIKey | AVOOUSLOTSWBEB-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01118134. With a topological polar surface area (TPSA) of 39.3 Ų, BAS 01118134 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01118134 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 01118134 is 332101-85-6.
The molecular formula of BAS 01118134 is C15H15N3O.
The molecular weight of BAS 01118134 is 253.1215 g/mol.
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