TL;DR: 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide (CAS 1005694-69-8) is a chemical compound with molecular formula C17H19ClN6O3 and molecular weight 390.12073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide
Also Known As: 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide, 4-{[2-(4-chloro-5-methyl-1H-pyrazol-1-yl)propanoyl]amino}-N-(furan-2-ylmethyl)-1-methyl-1H-pyrazole-3-carboxamide
| Molecular Formula | C17H19ClN6O3 |
| Molecular Weight | 390.12073 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.12073 Da |
| Heavy Atoms | 27 |
| Complexity | 553.0 |
| SMILES | CC1=C(C=NN1C(C)C(=O)NC2=CN(N=C2C(=O)NCC3=CC=CO3)C)Cl |
| InChIKey | IKGBLRFVOOLYLU-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide is 1005694-69-8.
The molecular formula of 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide is C17H19ClN6O3.
The molecular weight of 4-[2-(4-chloro-5-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide is 390.12073 g/mol.
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