TL;DR: 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride (CAS 1052421-37-0) is a chemical compound with molecular formula C16H22ClNO5 and molecular weight 343.11865 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate;hydrochloride
Also Known As: 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride, 1-morpholinopropan-2-yl 2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylate hydrochloride, 2,3-Dihydro-benzo[1,4]dioxine-6-carboxylic acid 1-methyl-2-morpholin-4-yl-ethyl ester
| Molecular Formula | C16H22ClNO5 |
| Molecular Weight | 343.11865 g/mol |
| XLogP | 1.7571 |
| Topological Polar Surface Area (TPSA) | 57.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.11865 Da |
| Heavy Atoms | 23 |
| Complexity | 372.0 |
| SMILES | CC(CN1CCOCC1)OC(=O)C2=CC3=C(C=C2)OCCO3.Cl |
| InChIKey | IEFIZVRNKNOMNP-UHFFFAOYSA-N |
The XLogP value of 1.7571 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride. With a topological polar surface area (TPSA) of 57.2 Ų, 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride is 1052421-37-0.
The molecular formula of 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride is C16H22ClNO5.
The molecular weight of 1-morpholin-4-ylpropan-2-yl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride is 343.11865 g/mol.
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