TL;DR: 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide (CAS 1005567-15-6) is a chemical compound with molecular formula C19H14Cl2N4O2S and molecular weight 432.02145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide
Also Known As: 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide, 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methylbenzothiazol-2-yl)pyrazole-3-carboxamide, 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide, 1-[(2,6-DICHLOROPHENOXY)METHYL]-N~3~-(4-METHYL-1,3-BENZOTHIAZOL-2-YL)-1H-PYRAZOLE-3-CARBOXAMIDE
| Molecular Formula | C19H14Cl2N4O2S |
| Molecular Weight | 432.02145 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 97.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.02145 Da |
| Heavy Atoms | 28 |
| Complexity | 550.0 |
| SMILES | CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=NN(C=C3)COC4=C(C=CC=C4Cl)Cl |
| InChIKey | GJHOQAAPGTXDMH-UHFFFAOYSA-N |
The XLogP value of 5.5 indicates that 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide is 1005567-15-6.
The molecular formula of 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide is C19H14Cl2N4O2S.
The molecular weight of 1-[(2,6-dichlorophenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide is 432.02145 g/mol.
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