TL;DR: 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide (CAS 154641-08-4) is a chemical compound with molecular formula C11H16IN5S and molecular weight 377.01712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide
Also Known As: 1-phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea hydroiodide, 1-phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide, 3-phenyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea Hydroiodide
| Molecular Formula | C11H16IN5S |
| Molecular Weight | 377.01712 g/mol |
| XLogP | 1.4449 |
| Topological Polar Surface Area (TPSA) | 92.6 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.01712 Da |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
| SMILES | C1CNC(=NC1)NNC(=S)NC2=CC=CC=C2.I |
| InChIKey | LFRAMNHARFKDOP-UHFFFAOYSA-N |
The XLogP value of 1.4449 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide. The TPSA of 92.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide. Following Lipinski's Rule of Five, 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide has 5 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 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide is 154641-08-4.
The molecular formula of 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide is C11H16IN5S.
The molecular weight of 1-Phenyl-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)thiourea;hydroiodide is 377.01712 g/mol.
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