TL;DR: C15H18N2O2 (CAS 1212486-17-3) is a chemical compound with molecular formula C15H18N2O2 and molecular weight 258.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,9R)-11-(4-hydroxybut-2-ynyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Also Known As: 3,11-Diazatricyclo[7.3.1.0(3.8)]trideca-5,7-dien-4-one, 11-(4-hydroxy-2-butynyl)-, (1R,5S)-3-(4-hydroxybut-2-yn-1-yl)-3,4,5,6-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-8(2H)-one
| Molecular Formula | C15H18N2O2 |
| Molecular Weight | 258.13684 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.13684 Da |
| Heavy Atoms | 19 |
| Complexity | 509.0 |
| SMILES | C1[C@@H]2CN(C[C@H]1C3=CC=CC(=O)N3C2)CC#CCO |
| InChIKey | YMPARQHFOKPMLE-OLZOCXBDSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C15H18N2O2. With a topological polar surface area (TPSA) of 43.8 Ų, C15H18N2O2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C15H18N2O2 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 C15H18N2O2 is 1212486-17-3.
The molecular formula of C15H18N2O2 is C15H18N2O2.
The molecular weight of C15H18N2O2 is 258.13684 g/mol.
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