TL;DR: Niagara 11637 (CAS 16146-62-6) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,2-dimethyl-3,4-dihydrochromen-8-yl) N-methylcarbamate
Also Known As: Niagara 11637, Niagara 10856, FMC 11637, 2,2-Dimethylchromanyl-8 N-methylcarbamate, ENT 27,385
| Molecular Formula | C13H17NO3 |
| Molecular Weight | 235.12085 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.12085 Da |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
| SMILES | CC1(CCC2=C(O1)C(=CC=C2)OC(=O)NC)C |
| InChIKey | XAMLYVOKCFEFDG-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Niagara 11637. With a topological polar surface area (TPSA) of 47.6 Ų, Niagara 11637 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Niagara 11637 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 Niagara 11637 is 16146-62-6.
The molecular formula of Niagara 11637 is C13H17NO3.
The molecular weight of Niagara 11637 is 235.12085 g/mol.
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