TL;DR: 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione (CAS 1351390-52-7) is a chemical compound with molecular formula C18H14N2O2 and molecular weight 290.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]isoindole-1,3-dione
Also Known As: 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione, 2-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]isoindole-1,3-dione, 2-(3,4-dihydro-1(2H)-naphthalenylideneamino)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C18H14N2O2 |
| Molecular Weight | 290.10553 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.10553 Da |
| Heavy Atoms | 22 |
| Complexity | 489.0 |
| SMILES | C1CC2=CC=CC=C2/C(=N/N3C(=O)C4=CC=CC=C4C3=O)/C1 |
| InChIKey | QEVGNPVWUUPOPB-KNTRCKAVSA-N |
The XLogP value of 3.2 indicates that 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione 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 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione is 1351390-52-7.
The molecular formula of 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione is C18H14N2O2.
The molecular weight of 2-[(1E)-3,4-dihydronaphthalen-1(2H)-ylideneamino]-1H-isoindole-1,3(2H)-dione is 290.10553 g/mol.
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