TL;DR: 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)- (CAS 99304-31-1) is a chemical compound with molecular formula C14H11BrN2O2 and molecular weight 318.0004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-3-hydroxy-3-(pyridin-2-ylmethyl)-1H-indol-2-one
Also Known As: 3-(Pyridyl-2-methyl)-5-bromodioxindole, Maybridge1_006362, 5-bromo-3-hydroxy-3-(2-pyridylmethyl)indolin-2-one, 5-bromo-3-hydroxy-3-(pyridin-2-ylmethyl)-1H-indol-2-one, 5-Bromo-3-hydroxy-3-(pyridin-2-ylmethyl)indolin-2-one
| Molecular Formula | C14H11BrN2O2 |
| Molecular Weight | 318.0004 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.0004 Da |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
| SMILES | C1=CC=NC(=C1)CC2(C3=C(C=CC(=C3)Br)NC2=O)O |
| InChIKey | APILDSXOVHTVRI-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)-. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)-. Following Lipinski's Rule of Five, 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)- has 2 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 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)- is 99304-31-1.
The molecular formula of 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)- is C14H11BrN2O2.
The molecular weight of 2H-Indol-2-one, 1,3-dihydro-5-bromo-3-hydroxy-3-(2-pyridinylmethyl)- is 318.0004 g/mol.
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