TL;DR: N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide (CAS 113906-02-8) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]furan-2-carboxamide
Also Known As: BAS 00921033, N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide, (E)-N'-((1-methyl-1H-pyrrol-2-yl)methylene)furan-2-carbohydrazide, N-[(1E)-2-(1-methylpyrrol-2-yl)-1-azavinyl]-2-furylcarboxamide, N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]furan-2-carboxamide
| Molecular Formula | C11H11N3O2 |
| Molecular Weight | 217.08513 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 59.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.08513 Da |
| Heavy Atoms | 16 |
| Complexity | 280.0 |
| SMILES | CN1C=CC=C1/C=N/NC(=O)C2=CC=CO2 |
| InChIKey | KDUWOJQUECBSSR-XYOKQWHBSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide. With a topological polar surface area (TPSA) of 59.5 Ų, N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide has 1 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'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide is 113906-02-8.
The molecular formula of N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide is C11H11N3O2.
The molecular weight of N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]furan-2-carbohydrazide is 217.08513 g/mol.
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