TL;DR: 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride (CAS 1052510-89-0) is a chemical compound with molecular formula C14H22ClNO3 and molecular weight 287.1288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(dimethylamino)propyl 2-(4-methoxyphenyl)acetate;hydrochloride
Also Known As: 3-(dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride, 3-dimethylaminopropyl 2-(4-methoxyphenyl)acetate Hydrochloride
| Molecular Formula | C14H22ClNO3 |
| Molecular Weight | 287.1288 g/mol |
| XLogP | 2.1544 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 287.1288 Da |
| Heavy Atoms | 19 |
| Complexity | 235.0 |
| SMILES | CN(C)CCCOC(=O)CC1=CC=C(C=C1)OC.Cl |
| InChIKey | PIJGWVKKTICXRG-UHFFFAOYSA-N |
The XLogP value of 2.1544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride. With a topological polar surface area (TPSA) of 38.8 Ų, 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride has 1 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 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride is 1052510-89-0.
The molecular formula of 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride is C14H22ClNO3.
The molecular weight of 3-(Dimethylamino)propyl 2-(4-methoxyphenyl)acetate hydrochloride is 287.1288 g/mol.
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