TL;DR: N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide (CAS 1026330-66-4) is a chemical compound with molecular formula C16H22ClN3O2 and molecular weight 323.14005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-chlorophenyl)-3-(2-morpholin-4-ylethylamino)but-2-enamide
Also Known As: N-(4-CHLOROPHENYL)-3-((2-MORPHOLIN-4-YLETHYL)AMINO)BUT-2-ENAMIDE, N-(4-chlorophenyl)-3-(2-morpholin-4-ylethylamino)but-2-enamide, N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide
| Molecular Formula | C16H22ClN3O2 |
| Molecular Weight | 323.14005 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.14005 Da |
| Heavy Atoms | 22 |
| Complexity | 376.0 |
| SMILES | CC(=CC(=O)NC1=CC=C(C=C1)Cl)NCCN2CCOCC2 |
| InChIKey | DGQIGADVXUSCLY-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide. With a topological polar surface area (TPSA) of 53.6 Ų, N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide has 2 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 N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide is 1026330-66-4.
The molecular formula of N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide is C16H22ClN3O2.
The molecular weight of N-(4-chlorophenyl)-3-(2-morpholinoethylamino)but-2-enamide is 323.14005 g/mol.
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