TL;DR: 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride (CAS 15009-61-7) is a chemical compound with molecular formula C21H29ClN2O2 and molecular weight 376.19174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl-[2-(2,6-dimethyl-4-phenylmethoxyanilino)-2-oxoethyl]azanium chloride
Also Known As: A 1212, 4'-(Benzyloxy)-2-(butylamino)-2',6'-acetoxylidide hydrochloride, 2',6'-ACETOXYLIDIDE, 4'-(BENZYLOXY)-2-(BUTYLAMINO)-, HYDROCHLORIDE, butyl-[2-(2,6-dimethyl-4-phenylmethoxyanilino)-2-oxoethyl]azanium chloride
| Molecular Formula | C21H29ClN2O2 |
| Molecular Weight | 376.19174 g/mol |
| XLogP | 0.19 |
| Topological Polar Surface Area (TPSA) | 54.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 376.19174 Da |
| Heavy Atoms | 26 |
| Complexity | 370.0 |
| SMILES | CCCC[NH2+]CC(=O)NC1=C(C=C(C=C1C)OCC2=CC=CC=C2)C.[Cl-] |
| InChIKey | RCMAHGUXSTURCB-UHFFFAOYSA-N |
The XLogP value of 0.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride. With a topological polar surface area (TPSA) of 54.9 Ų, 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride is 15009-61-7.
The molecular formula of 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride is C21H29ClN2O2.
The molecular weight of 2',6'-Acetoxylidide, 4'-(benzyloxy)-2-(butylamino)-, hydrochloride is 376.19174 g/mol.
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