TL;DR: Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride (CAS 97769-25-0) is a chemical compound with molecular formula C16H25ClN2O4 and molecular weight 344.1503 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-hydroxy-3-piperidin-1-ium-1-ylpropyl) N-(2-methoxyphenyl)carbamate chloride
Also Known As: o-Methoxycarbanilic acid 2-hydroxy-3-piperidinopropyl ester hydrochloride, 3-Piperidino-1,2-propanediol 1-(o-methoxycarbanilate) hydrochloride, 1,2-Propanediol, 3-piperidino-, 1-o-methoxycarbanilate, hydrochloride, CARBANILIC ACID, o-METHOXY-, 2-HYDROXY-3-PIPERIDINOPROPYL ESTER, HYDROCHLORIDE, (2-hydroxy-3-piperidin-1-ium-1-ylpropyl) N-(2-methoxyphenyl)carbamate chloride
| Molecular Formula | C16H25ClN2O4 |
| Molecular Weight | 344.1503 g/mol |
| XLogP | -2.32 |
| Topological Polar Surface Area (TPSA) | 72.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 344.1503 Da |
| Heavy Atoms | 23 |
| Complexity | 334.0 |
| SMILES | COC1=CC=CC=C1NC(=O)OCC(C[NH+]2CCCCC2)O.[Cl-] |
| InChIKey | BTJOAEPREXEEPI-UHFFFAOYSA-N |
The XLogP value of -2.32 indicates that Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride. Following Lipinski's Rule of Five, Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride has 3 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 Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride is 97769-25-0.
The molecular formula of Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride is C16H25ClN2O4.
The molecular weight of Carbanilic acid, o-methoxy-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride is 344.1503 g/mol.
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