TL;DR: RefChem:220106 (CAS 147017-70-7) is a chemical compound with molecular formula C15H24ClN3O3 and molecular weight 329.1506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[2-(diethylamino)ethoxy]-2,3-dihydro-1,4-benzodioxine-3-carboximidamide;hydrochloride
Also Known As: 2,3-Dihydro-N-(2-(diethylamino)ethoxy)-1,4-benzodioxin-2-carboximidamide monohydrochloride, 1,4-Benzodioxin-2-carboximidamide, 2,3-dihydro-N-(2-(diethylamino)ethoxy)-, monohydrochloride, N-[2-(Diethylamino)ethoxy]-2,3-dihydro-1,4-benzodioxine-2-carboximidamide--hydrogen chloride (1/1)
| Molecular Formula | C15H24ClN3O3 |
| Molecular Weight | 329.1506 g/mol |
| XLogP | 1.8788 |
| Topological Polar Surface Area (TPSA) | 69.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 329.1506 Da |
| Heavy Atoms | 22 |
| Complexity | 334.0 |
| SMILES | CCN(CC)CCO/N=C(/C1COC2=CC=CC=C2O1)\N.Cl |
| InChIKey | VGCYSQHQVXVFFM-UHFFFAOYSA-N |
The XLogP value of 1.8788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:220106. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:220106. Following Lipinski's Rule of Five, RefChem:220106 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:220106 is 147017-70-7.
The molecular formula of RefChem:220106 is C15H24ClN3O3.
The molecular weight of RefChem:220106 is 329.1506 g/mol.
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