TL;DR: Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride (CAS 112764-17-7) is a chemical compound with molecular formula C28H38Cl2N4O4 and molecular weight 564.227 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(diethylamino)-N-[4-[3-(diethylamino)propanoylamino]-9,10-dioxoanthracen-1-yl]propanamide;dihydrochloride
Also Known As: Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride, n,n'-(9,10-dioxo-9,10-dihydroanthracene-1,4-diyl)bis[3-(diethylamino)propanamide] dihydrochloride(non-preferred name), 3-(diethylamino)-N-[4-[3-(diethylamino)propanoylamino]-9,10-dioxoanthracen-1-yl]propanamide dihydrochloride, N,N'-(9,10-Dioxo-9,10-dihydroanthracene-1,4-diyl)bis[3-(diethylamino)propanamide]--hydrogen chloride (1/2)
| Molecular Formula | C28H38Cl2N4O4 |
| Molecular Weight | 564.227 g/mol |
| XLogP | 4.6464 |
| Topological Polar Surface Area (TPSA) | 98.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 564.227 Da |
| Heavy Atoms | 38 |
| Complexity | 716.0 |
| SMILES | CCN(CC)CCC(=O)NC1=C2C(=C(C=C1)NC(=O)CCN(CC)CC)C(=O)C3=CC=CC=C3C2=O.Cl.Cl |
| InChIKey | HPXUZWFENGFOSO-UHFFFAOYSA-N |
The XLogP value of 4.6464 indicates that Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride. Following Lipinski's Rule of Five, Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride is 112764-17-7.
The molecular formula of Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride is C28H38Cl2N4O4.
The molecular weight of Propanamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(3-(diethylamino)-, dihydrochloride is 564.227 g/mol.
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