TL;DR: RefChem:305644 (CAS 63956-96-7) is a chemical compound with molecular formula C19H30ClNO5 and molecular weight 387.18124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl-[2-hydroxy-3-[(5-hydroxy-2-methyl-3,4,6,7-tetrahydro-2H-furo[3,2-g]chromen-9-yl)oxy]propyl]azanium chloride
Also Known As: 5H-Furo(3,2-g)(1)benzopyran, 2,3,6,7-tetrahydro-9-(3-(tert-butylamino)-2-hydroxypropoxy)-4-hydroxy-7-methyl-, hydrochloride, tert-butyl-[2-hydroxy-3-[(5-hydroxy-2-methyl-3,4,6,7-tetrahydro-2H-furo[3,2-g]chromen-9-yl)oxy]propyl]azanium chloride, 5H-FURO(3,2-g)(1)BENZOPYRAN, 2,3,6,7-TETRAHYDRO-9-(3-(tert-BUTYLAMINO)-2-HYDROXY, 5H-Furo[3,2-g][1]benzopyran-4-ol, 9-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-2,3-dihydro-7-methyl-, hydrochloride
| Molecular Formula | C19H30ClNO5 |
| Molecular Weight | 387.18124 g/mol |
| XLogP | -1.36 |
| Topological Polar Surface Area (TPSA) | 84.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.18124 Da |
| Heavy Atoms | 26 |
| Complexity | 626.0 |
| SMILES | CC1CC2=C(O1)C(=C3C(=C(CCO3)O)C2)OCC(C[NH2+]C(C)(C)C)O.[Cl-] |
| InChIKey | QGXQXDZTGAZOJC-UHFFFAOYSA-N |
The XLogP value of -1.36 indicates that RefChem:305644 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:305644. Following Lipinski's Rule of Five, RefChem:305644 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:305644 is 63956-96-7.
The molecular formula of RefChem:305644 is C19H30ClNO5.
The molecular weight of RefChem:305644 is 387.18124 g/mol.
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