TL;DR: 5H-Dibenzarsenole, 5-cyano- (CAS 63918-65-0) is a chemical compound with molecular formula C13H8AsN and molecular weight 252.98727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzo[b]arsindole-5-carbonitrile
Also Known As: 5H-Dibenzarsenole, 5-cyano-, 5-Cyano-5H-dibenzarsenole, 5H-Dibenzarsole-5-carbonitrile, TL 65, benzo[b]arsindole-5-carbonitrile
| Molecular Formula | C13H8AsN |
| Molecular Weight | 252.98727 g/mol |
| XLogP | 1.34 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 252.98727 Da |
| Heavy Atoms | 15 |
| Complexity | 270.0 |
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3[As]2C#N |
| InChIKey | PWEBTIBAMLCDLV-UHFFFAOYSA-N |
The XLogP value of 1.34 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Dibenzarsenole, 5-cyano-. With a topological polar surface area (TPSA) of 23.8 Ų, 5H-Dibenzarsenole, 5-cyano- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzarsenole, 5-cyano- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5H-Dibenzarsenole, 5-cyano- is 63918-65-0.
The molecular formula of 5H-Dibenzarsenole, 5-cyano- is C13H8AsN.
The molecular weight of 5H-Dibenzarsenole, 5-cyano- is 252.98727 g/mol.
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