TL;DR: [(E)-1-(3-methylphenyl)ethylideneamino]urea (CAS 120445-90-1) is a chemical compound with molecular formula C10H13N3O and molecular weight 191.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(E)-1-(3-methylphenyl)ethylideneamino]urea
Also Known As: 1-m-tolyl-ethanone semicarbazone, [1-(3-methylphenyl)ethylideneamino]urea
| Molecular Formula | C10H13N3O |
| Molecular Weight | 191.10587 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.10587 Da |
| Heavy Atoms | 14 |
| Complexity | 238.0 |
| SMILES | CC1=CC(=CC=C1)/C(=N/NC(=O)N)/C |
| InChIKey | UUBKAAAVTFGQEB-XYOKQWHBSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-1-(3-methylphenyl)ethylideneamino]urea. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(E)-1-(3-methylphenyl)ethylideneamino]urea. Following Lipinski's Rule of Five, [(E)-1-(3-methylphenyl)ethylideneamino]urea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [(E)-1-(3-methylphenyl)ethylideneamino]urea is 120445-90-1.
The molecular formula of [(E)-1-(3-methylphenyl)ethylideneamino]urea is C10H13N3O.
The molecular weight of [(E)-1-(3-methylphenyl)ethylideneamino]urea is 191.10587 g/mol.
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