TL;DR: N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide (CAS 159212-36-9) is a chemical compound with molecular formula C13H15N3O2 and molecular weight 245.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[(2-hydroxy-1H-indol-3-yl)methylideneamino]ethyl]acetamide
Also Known As: BIM-0007811.P001, N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide, Acetamide, N-(2-(((2-oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)-, N-(2-{[(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]amino}ethyl)acetamide, N-[2-[(2-oxo-1H-indol-3-ylidene)methylamino]ethyl]acetamide
| Molecular Formula | C13H15N3O2 |
| Molecular Weight | 245.11642 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 77.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.11642 Da |
| Heavy Atoms | 18 |
| Complexity | 319.0 |
| SMILES | CC(=O)NCCN=CC1=C(NC2=CC=CC=C21)O |
| InChIKey | BIMVBNAGCRSGDC-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide. Following Lipinski's Rule of Five, N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide 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 N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide is 159212-36-9.
The molecular formula of N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide is C13H15N3O2.
The molecular weight of N-(2-(((2-Oxo-1,3-dihydro-2H-indol-3-ylene)methyl)amino)ethyl)acetamide is 245.11642 g/mol.
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