TL;DR: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)- (CAS 128023-25-6) is a chemical compound with molecular formula C15H19NO3Si and molecular weight 289.11343 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-prop-1-ynylphenyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Also Known As: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)-, 1-(4-(1-Propynyl)phenyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-[4-(PROP-1-YN-1-YL)PHENYL]-2,8,9-TRIOXA-5-AZA-1-SILABICYCLO[3.3.3]UNDECANE, 5-(4-prop-1-ynylphenyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
| Molecular Formula | C15H19NO3Si |
| Molecular Weight | 289.11343 g/mol |
| XLogP | 0.5829 |
| Topological Polar Surface Area (TPSA) | 30.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.11343 Da |
| Heavy Atoms | 20 |
| Complexity | 368.0 |
| SMILES | CC#CC1=CC=C(C=C1)[Si]23OCCN(CCO2)CCO3 |
| InChIKey | DNMBQVICMRWJHI-UHFFFAOYSA-N |
The XLogP value of 0.5829 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)-. With a topological polar surface area (TPSA) of 30.9 Ų, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)- is 128023-25-6.
The molecular formula of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)- is C15H19NO3Si.
The molecular weight of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-(1-propynyl)phenyl)- is 289.11343 g/mol.
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