TL;DR: 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate (CAS 63986-55-0) is a chemical compound with molecular formula C19H32N2O3 and molecular weight 336.2413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(diethylamino)propan-2-yl N-(4-butoxy-2-methylphenyl)carbamate
Also Known As: KL 3631, 1-((Diethylamino)methyl)ethyl 4-butoxy-2-methylcarbanilate, 1-(diethylamino)propan-2-yl N-(4-butoxy-2-methylphenyl)carbamate, 4-Butoxy-2-methylcarbanilic acid 1-((diethylamino)methyl)ethyl ester, 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate
| Molecular Formula | C19H32N2O3 |
| Molecular Weight | 336.2413 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 336.2413 Da |
| Heavy Atoms | 24 |
| Complexity | 348.0 |
| SMILES | CCCCOC1=CC(=C(C=C1)NC(=O)OC(C)CN(CC)CC)C |
| InChIKey | KWINYYONAJBBOU-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate 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 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is 63986-55-0.
The molecular formula of 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is C19H32N2O3.
The molecular weight of 1-(Diethylamino)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is 336.2413 g/mol.
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