TL;DR: N-Acetyldehydroanonaine (CAS 132646-11-8) is a chemical compound with molecular formula C19H15NO3 and molecular weight 305.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,12,14,16,18-heptaen-11-yl)ethanone
Also Known As: N-Acetyldehydroanonaine, 6-Acetyl-1,2-methylenedioxy-5,6-dihydro-4H-dibenzo[de,g]quinoline, 1-(5,6-Dihydro-2H,7H-[1,3]benzodioxolo[6,5,4-de]benzo[g]quinolin-7-yl)ethan-1-one, 1-(5,6-Dihydro-7H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-7-yl)ethanone, 1-{3,5-dioxa-11-azapentacyclo[10.7.1.0^{2,6}.0^{8,20}.0^{14,19}]icosa-1,6,8(20),12,14,16,18-heptaen-11-yl}ethan-1-one
| Molecular Formula | C19H15NO3 |
| Molecular Weight | 305.1052 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 305.1052 Da |
| Heavy Atoms | 23 |
| Complexity | 495.0 |
| SMILES | CC(=O)N1CCC2=CC3=C(C4=C2C1=CC5=CC=CC=C54)OCO3 |
| InChIKey | FNUSCCFSHRMQQM-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that N-Acetyldehydroanonaine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, N-Acetyldehydroanonaine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Acetyldehydroanonaine has 0 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 N-Acetyldehydroanonaine is 132646-11-8.
The molecular formula of N-Acetyldehydroanonaine is C19H15NO3.
The molecular weight of N-Acetyldehydroanonaine is 305.1052 g/mol.
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