TL;DR: 4-Amino-3-(diethylamino-methyl)-chromen-2-one (CAS 167866-50-4) is a chemical compound with molecular formula C14H18N2O2 and molecular weight 246.13683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-3-(diethylaminomethyl)chromen-2-one
Also Known As: 4-amino-3-(diethylaminomethyl)chromen-2-one, 4-amino-3-(diethylamino-methyl)-chromen-2-one, 4-amino-3-[(diethylamino)methyl]-2H-chromen-2-one, 4-Amino-3-[(diethylamino)methyl]-2H-1-benzopyran-2-one, 2H-1-Benzopyran-2-one, 4-amino-3-[(diethylamino)methyl]- (en)
| Molecular Formula | C14H18N2O2 |
| Molecular Weight | 246.13683 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.13683 Da |
| Heavy Atoms | 18 |
| Complexity | 348.0 |
| SMILES | CCN(CC)CC1=C(C2=CC=CC=C2OC1=O)N |
| InChIKey | NZBSJUAJWQXGPM-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3-(diethylamino-methyl)-chromen-2-one. With a topological polar surface area (TPSA) of 55.6 Ų, 4-Amino-3-(diethylamino-methyl)-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Amino-3-(diethylamino-methyl)-chromen-2-one 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 4-Amino-3-(diethylamino-methyl)-chromen-2-one is 167866-50-4.
The molecular formula of 4-Amino-3-(diethylamino-methyl)-chromen-2-one is C14H18N2O2.
The molecular weight of 4-Amino-3-(diethylamino-methyl)-chromen-2-one is 246.13683 g/mol.
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