TL;DR: 1-(diphenylmethyl)-1H-indole-2,3-dione (CAS 1108668-13-8) is a chemical compound with molecular formula C21H15NO2 and molecular weight 313.1103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzhydrylindole-2,3-dione
Also Known As: 1-Benzhydrylindoline-2,3-dione, N-benzhydrylisatin, 1-(diphenylmethyl)-1H-indole-2,3-dione, 1-benzhydrylindole-2,3-dione, N-benzhydryl isatin
| Molecular Formula | C21H15NO2 |
| Molecular Weight | 313.1103 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.1103 Da |
| Heavy Atoms | 24 |
| Complexity | 458.0 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=CC=CC=C4C(=O)C3=O |
| InChIKey | ZWWDFMHULDPTEF-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 1-(diphenylmethyl)-1H-indole-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 1-(diphenylmethyl)-1H-indole-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(diphenylmethyl)-1H-indole-2,3-dione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(diphenylmethyl)-1H-indole-2,3-dione is 1108668-13-8.
The molecular formula of 1-(diphenylmethyl)-1H-indole-2,3-dione is C21H15NO2.
The molecular weight of 1-(diphenylmethyl)-1H-indole-2,3-dione is 313.1103 g/mol.
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