TL;DR: 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl- (CAS 152235-91-1) is a chemical compound with molecular formula C22H31N3O3 and molecular weight 385.23654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[3-[3-aminopropyl(methyl)amino]propylamino]methyl]-2,5,9-trimethylfuro[3,2-g]chromen-7-one
Also Known As: 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl-, 3-[({3-[(3-Aminopropyl)(methyl)amino]propyl}amino)methyl]-2,5,9-trimethyl-7H-furo[3,2-g][1]benzopyran-7-one, 3-[[3-[3-aminopropyl(methyl)amino]propylamino]methyl]-2,5,9-trimethylfuro[3,2-g]chromen-7-one
| Molecular Formula | C22H31N3O3 |
| Molecular Weight | 385.23654 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 80.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 385.23654 Da |
| Heavy Atoms | 28 |
| Complexity | 567.0 |
| SMILES | CC1=CC(=O)OC2=C(C3=C(C=C12)C(=C(O3)C)CNCCCN(C)CCCN)C |
| InChIKey | BWWJBDJRONOFFB-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl-. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl-. Following Lipinski's Rule of Five, 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl- has 2 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 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl- is 152235-91-1.
The molecular formula of 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl- is C22H31N3O3.
The molecular weight of 7H-Furo(3,2-g)(1)benzopyran-7-one, 3-(((3-((3-aminopropyl)methylamino)propyl)amino)methyl)-2,5,9-trimethyl- is 385.23654 g/mol.
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