TL;DR: 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide (CAS 1005622-86-5) is a chemical compound with molecular formula C17H14Cl2N4O3 and molecular weight 392.04428 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-1-methylpyrazole-5-carboxamide
Also Known As: 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide, 4-[(2,4-dichlorobenzoyl)amino]-N-(2-furylmethyl)-2-methyl-pyrazole-3-carboxamide, 4-[(2,4-DICHLOROBENZOYL)AMINO]-N-(2-FURYLMETHYL)-1-METHYL-1H-PYRAZOLE-5-CARBOXAMIDE, 4-{[(2,4-dichlorophenyl)carbonyl]amino}-N-(furan-2-ylmethyl)-1-methyl-1H-pyrazole-5-carboxamide
| Molecular Formula | C17H14Cl2N4O3 |
| Molecular Weight | 392.04428 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 89.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.04428 Da |
| Heavy Atoms | 26 |
| Complexity | 524.0 |
| SMILES | CN1C(=C(C=N1)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)NCC3=CC=CO3 |
| InChIKey | BDGRWXSZOUWWLE-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide is 1005622-86-5.
The molecular formula of 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide is C17H14Cl2N4O3.
The molecular weight of 4-[(2,4-dichlorobenzoyl)amino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide is 392.04428 g/mol.
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