TL;DR: 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine (CAS 152714-07-3) is a chemical compound with molecular formula C10H11N5O and molecular weight 217.09636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2-hydroxy-1H-indol-3-yl)imino]-2-methylguanidine
Also Known As: 3-(4-chlorophenyl)cyclobutanone, NCI60_034828, 2-methyl-1-[(2-oxoindol-3-yl)amino]guanidine, 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine, N-Methyl-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarboximidamide
| Molecular Formula | C10H11N5O |
| Molecular Weight | 217.09636 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.09636 Da |
| Heavy Atoms | 16 |
| Complexity | 304.0 |
| SMILES | CN=C(N)N=NC1=C(NC2=CC=CC=C21)O |
| InChIKey | UGPIXTFZKJOHJT-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine. Following Lipinski's Rule of Five, 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine 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 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine is 152714-07-3.
The molecular formula of 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine is C10H11N5O.
The molecular weight of 1-methyl-3-[(Z)-(2-oxoindolin-3-ylidene)amino]guanidine is 217.09636 g/mol.
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