TL;DR: [(Z)-thiocan-3-ylideneamino]urea (CAS 103794-90-7) is a chemical compound with molecular formula C8H15N3OS and molecular weight 201.09358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(Z)-thiocan-3-ylideneamino]urea
Also Known As: 3-thiocanone semicarbazone, [(Z)-thiocan-3-ylideneamino]urea, AO-289/15480012
| Molecular Formula | C8H15N3OS |
| Molecular Weight | 201.09358 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 92.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.09358 Da |
| Heavy Atoms | 13 |
| Complexity | 206.0 |
| SMILES | C1CC/C(=N/NC(=O)N)/CSCC1 |
| InChIKey | DCDCQGVZOFVVHW-YFHOEESVSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(Z)-thiocan-3-ylideneamino]urea. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [(Z)-thiocan-3-ylideneamino]urea. Following Lipinski's Rule of Five, [(Z)-thiocan-3-ylideneamino]urea 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 [(Z)-thiocan-3-ylideneamino]urea is 103794-90-7.
The molecular formula of [(Z)-thiocan-3-ylideneamino]urea is C8H15N3OS.
The molecular weight of [(Z)-thiocan-3-ylideneamino]urea is 201.09358 g/mol.
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