TL;DR: 3-Hydrazono-1H-2-indolinone der. (CAS 166323-91-7) is a chemical compound with molecular formula C10H9BrN4OS and molecular weight 311.96805 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]-3-methylthiourea
Also Known As: 3-Hydrazono-1H-2-indolinone der., Hydrazinecarbothioamide, 2-(5-bromo-1,2-dihydro-2-oxo-3H-indol-3-ylidene)-N-methyl-, 1-[(5-bromo-2-oxoindol-3-yl)amino]-3-methylthiourea, 1-(5-Bromo-2-oxoindolin-3-ylidene)-4-methylthiosemicarbazide, 1-[(Z)-(5-bromo-2-oxo-indolin-3-ylidene)amino]-3-methyl-thiourea
| Molecular Formula | C10H9BrN4OS |
| Molecular Weight | 311.96805 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.96805 Da |
| Heavy Atoms | 17 |
| Complexity | 327.0 |
| SMILES | CNC(=S)N=NC1=C(NC2=C1C=C(C=C2)Br)O |
| InChIKey | BJDNMLYBINYZOU-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 3-Hydrazono-1H-2-indolinone der. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydrazono-1H-2-indolinone der.. Following Lipinski's Rule of Five, 3-Hydrazono-1H-2-indolinone der. has 3 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 3-Hydrazono-1H-2-indolinone der. is 166323-91-7.
The molecular formula of 3-Hydrazono-1H-2-indolinone der. is C10H9BrN4OS.
The molecular weight of 3-Hydrazono-1H-2-indolinone der. is 311.96805 g/mol.
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