TL;DR: 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea (CAS 152944-67-7) is a chemical compound with molecular formula C8H10N4S and molecular weight 194.06262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-3-(pyridin-2-ylmethylideneamino)thiourea
Also Known As: NCIOpen2_000081, 3-methyl-1-(pyridin-2-ylmethylideneamino)thiourea, 2-formylpyridine n4-methylthiosemicarbazone, 2-Pyridinecarbaldehyde N-methylthiosemicarbazone, 1-methyl-3-(pyridin-2-ylmethylideneamino)thiourea
| Molecular Formula | C8H10N4S |
| Molecular Weight | 194.06262 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 81.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.06262 Da |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
| SMILES | CNC(=S)NN=CC1=CC=CC=N1 |
| InChIKey | PIQCUQKVCKNFCL-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea. Following Lipinski's Rule of Five, 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea 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 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea is 152944-67-7.
The molecular formula of 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea is C8H10N4S.
The molecular weight of 3-Methyl-1-(pyridin-2-ylmethylideneamino)thiourea is 194.06262 g/mol.
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