TL;DR: RefChem:1085165 (CAS 15620-23-2) is a chemical compound with molecular formula C24H29NO5 and molecular weight 411.20456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[2-(2-tricyclo[10.4.0.03,8]hexadeca-1(16),3,5,7,12,14-hexaenyloxy)ethyl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: Ethylamine, N,N-dimethyl-2-((5,6,7,12-tetrahydrodibenzo(a,d)cycloocten-12-yl)oxy)-, maleate (1:1), 5,6,7,12-Tetrahydro-12-(2-(dimethylamino)ethoxy)dibenzo(a,d)cyclooctene maleate
| Molecular Formula | C24H29NO5 |
| Molecular Weight | 411.20456 g/mol |
| XLogP | 0.8029 |
| Topological Polar Surface Area (TPSA) | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.20456 Da |
| Heavy Atoms | 30 |
| Complexity | 435.0 |
| SMILES | C[NH+](C)CCOC1C2=CC=CC=C2CCCC3=CC=CC=C13.C(=C\C(=O)[O-])\C(=O)O |
| InChIKey | XTXHHQKOGBNWKM-BTJKTKAUSA-N |
The XLogP value of 0.8029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1085165. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1085165. Following Lipinski's Rule of Five, RefChem:1085165 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1085165 is 15620-23-2.
The molecular formula of RefChem:1085165 is C24H29NO5.
The molecular weight of RefChem:1085165 is 411.20456 g/mol.
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