TL;DR: 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate hydrochloride (CAS 1078726-92-7) is a chemical compound with molecular formula C22H26ClNO3 and molecular weight 387.16013 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-piperidin-1-ylpropan-2-yl 9H-xanthene-9-carboxylate;hydrochloride
Also Known As: 1-(PIPERIDIN-1-YL)PROPAN-2-YL 9H-XANTHENE-9-CARBOXYLATE HYDROCHLORIDE, 9H-Xanthene-9-carboxylic acid 1-methyl-2-piperidin-1-yl-ethyl ester
| Molecular Formula | C22H26ClNO3 |
| Molecular Weight | 387.16013 g/mol |
| XLogP | 4.7636 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.16013 Da |
| Heavy Atoms | 27 |
| Complexity | 454.0 |
| SMILES | CC(CN1CCCCC1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24.Cl |
| InChIKey | SJVFJRYZVOHVOJ-UHFFFAOYSA-N |
The XLogP value of 4.7636 indicates that 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate 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 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate hydrochloride is 1078726-92-7.
The molecular formula of 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate hydrochloride is C22H26ClNO3.
The molecular weight of 1-(Piperidin-1-YL)propan-2-YL 9H-xanthene-9-carboxylate hydrochloride is 387.16013 g/mol.
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