TL;DR: 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea (CAS 1005696-59-2) is a chemical compound with molecular formula C11H17N5OS and molecular weight 267.1154 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea
Also Known As: 1-cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea, N-cyclopropyl-2-[3-(3-methyl-1H-pyrazol-1-yl)propanoyl]hydrazinecarbothioamide, N~1~-CYCLOPROPYL-2-[3-(3-METHYL-1H-PYRAZOL-1-YL)PROPANOYL]-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C11H17N5OS |
| Molecular Weight | 267.1154 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.1154 Da |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
| SMILES | CC1=NN(C=C1)CCC(=O)NNC(=S)NC2CC2 |
| InChIKey | NBEMFZDGWRGLTM-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea. Following Lipinski's Rule of Five, 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea has 3 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 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea is 1005696-59-2.
The molecular formula of 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea is C11H17N5OS.
The molecular weight of 1-Cyclopropyl-3-[3-(3-methylpyrazol-1-yl)propanoylamino]thiourea is 267.1154 g/mol.
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