TL;DR: RefChem:305643 (CAS 63956-97-8) is a chemical compound with molecular formula C18H28ClNO5 and molecular weight 373.1656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-hydroxy-3-[(5-hydroxy-2-methyl-3,4,6,7-tetrahydro-2H-furo[3,2-g]chromen-9-yl)oxy]propyl]-propan-2-ylazanium chloride
Also Known As: 5H-Furo(3,2-g)(1)benzopyran, 2,3,6,7-tetrahydro-4-hydroxy-9-(3-isopropylamino-2-hydroxypropoxy)-7-methyl-, hydrochloride, [2-hydroxy-3-[(5-hydroxy-2-methyl-3,4,6,7-tetrahydro-2H-furo[3,2-g]chromen-9-yl)oxy]propyl]-propan-2-ylazanium chloride, 5H-FURO(3,2-g)(1)BENZOPYRAN, 2,3,6,7-TETRAHYDRO-4-HYDROXY-9-(3-ISOPROPYLAMINO-2-, 5H-Furo[3,2-g][1]benzopyran-4-ol, 2,3-dihydro-9-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-7-methyl-, hydrochloride
| Molecular Formula | C18H28ClNO5 |
| Molecular Weight | 373.1656 g/mol |
| XLogP | -1.75 |
| Topological Polar Surface Area (TPSA) | 84.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.1656 Da |
| Heavy Atoms | 25 |
| Complexity | 590.0 |
| SMILES | CC1CC2=C(O1)C(=C3C(=C(CCO3)O)C2)OCC(C[NH2+]C(C)C)O.[Cl-] |
| InChIKey | OABHDWXCYXOGSP-UHFFFAOYSA-N |
The XLogP value of -1.75 indicates that RefChem:305643 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:305643. Following Lipinski's Rule of Five, RefChem:305643 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:305643 is 63956-97-8.
The molecular formula of RefChem:305643 is C18H28ClNO5.
The molecular weight of RefChem:305643 is 373.1656 g/mol.
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