TL;DR: Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)- (CAS 101198-09-8) is a chemical compound with molecular formula C20H28N2O2 and molecular weight 328.2151 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,3,3a,6,7,8-hexahydro-1H-benzo[de]quinolin-4-yl)-N-butanoylbutanamide
Also Known As: 9-(Dibutyroamido)julolidine, N-(2,3,6,7-Tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)dibutyramide, DIBUTYRAMIDE, N-(2,3,6,7-TETRAHYDRO-1H,5H-BENZO(ij)QUINOLIZIN-9-YL)-, n-butanoyl-n-(2,3,3a,6,7,8-hexahydro-1h-benzo[de]quinolin-4-yl)butanamide, N-(2,3,3a,6,7,8-hexahydro-1H-benzo[de]quinolin-4-yl)-N-butanoylbutanamide
| Molecular Formula | C20H28N2O2 |
| Molecular Weight | 328.2151 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.2151 Da |
| Heavy Atoms | 24 |
| Complexity | 610.0 |
| SMILES | CCCC(=O)N(C1=CCC2=C3C1CCNC3=CCC2)C(=O)CCC |
| InChIKey | XCXMHKHESXWZGY-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)-. With a topological polar surface area (TPSA) of 49.4 Ų, Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)- has 1 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 Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)- is 101198-09-8.
The molecular formula of Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)- is C20H28N2O2.
The molecular weight of Dibutyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)- is 328.2151 g/mol.
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