TL;DR: 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea (CAS 1022808-93-0) is a chemical compound with molecular formula C12H14N2OS and molecular weight 234.08269 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(cyclopropylcarbamothioyl)-2-phenylacetamide
Also Known As: 1-(CYCLOPROPYL)-3-(2-PHENYLACETYL)THIOUREA, 3-cyclopropyl-1-(2-phenylacetyl)thiourea, N-(cyclopropylcarbamothioyl)-2-phenylacetamide, N-(cyclopropylcarbamothioyl)-2-phenyl-acetamide, N-(cyclopropylthiocarbamoyl)-2-phenyl-acetamide
| Molecular Formula | C12H14N2OS |
| Molecular Weight | 234.08269 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 73.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.08269 Da |
| Heavy Atoms | 16 |
| Complexity | 270.0 |
| SMILES | C1CC1NC(=S)NC(=O)CC2=CC=CC=C2 |
| InChIKey | DRNDYCGUKYWDKY-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea. Following Lipinski's Rule of Five, 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea 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 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea is 1022808-93-0.
The molecular formula of 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea is C12H14N2OS.
The molecular weight of 1-(Cyclopropyl)-3-(2-phenylacetyl)thiourea is 234.08269 g/mol.
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