TL;DR: 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide (CAS 116850-74-9) is a chemical compound with molecular formula C7H9N3OS2 and molecular weight 215.0187 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-3-(thiophene-2-carbonylamino)thiourea
Also Known As: Maybridge1_004571, N-methyl-2-(2-thienylcarbonyl)hydrazinecarbothioamide, 1-(2-Thenoyl)-4-methylthiosemicarbazide, 1-methyl-3-(thiophene-2-carbonylamino)thiourea, N-Methyl-2-(thiophene-2-carbonyl)hydrazinecarbothioamide
| Molecular Formula | C7H9N3OS2 |
| Molecular Weight | 215.0187 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.0187 Da |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
| SMILES | CNC(=S)NNC(=O)C1=CC=CS1 |
| InChIKey | SYXUJKFYUBHYNO-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide. Following Lipinski's Rule of Five, 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide 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 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide is 116850-74-9.
The molecular formula of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide is C7H9N3OS2.
The molecular weight of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide is 215.0187 g/mol.
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