TL;DR: BAS 09667694 (CAS 1212489-23-0) is a chemical compound with molecular formula C16H25N3O and molecular weight 275.19977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-methylspiro[3,5,9-triazatricyclo[5.3.3.01,6]tridec-5-ene-4,1'-cyclohexane]-2-one
Also Known As: BAS 09667694, BRD-A43971957-001-14-2, 4-Spirocyclohexyl-9-methyl-3,5,9-triaza-tricyclo[5.3.3.0(1,6)]tridec-5-en-2-one, 6-methyl-2,6,10-triazatetracyclo[9.-1.5.3<4,8>.0<3,8>]octadec-2-en-9-one, (4aR,8R)-10-methyl-5,6,7,8-tetrahydrospiro[4a,8-(methanoiminomethano)quinazoline-2,1'-cyclohexan]-4(3H)-one
| Molecular Formula | C16H25N3O |
| Molecular Weight | 275.19977 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 275.19977 Da |
| Heavy Atoms | 20 |
| Complexity | 466.0 |
| SMILES | CN1CC2CCCC3(C1)C2=NC4(CCCCC4)NC3=O |
| InChIKey | AYPMERHGGUTLLS-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09667694. With a topological polar surface area (TPSA) of 44.7 Ų, BAS 09667694 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 09667694 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 09667694 is 1212489-23-0.
The molecular formula of BAS 09667694 is C16H25N3O.
The molecular weight of BAS 09667694 is 275.19977 g/mol.
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