TL;DR: Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)- (CAS 141284-26-6) is a chemical compound with molecular formula C16H12F3N3O3S2 and molecular weight 415.02722 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(methanesulfonamido)-5-(trifluoromethyl)-3-pyridinyl]-1-benzothiophene-2-carboxamide
Also Known As: Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-, N-[2-(methanesulfonamido)-5-(trifluoromethyl)pyridin-3-yl]-1-benzothiophene-2-carboxamide
| Molecular Formula | C16H12F3N3O3S2 |
| Molecular Weight | 415.02722 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.02722 Da |
| Heavy Atoms | 27 |
| Complexity | 654.0 |
| SMILES | CS(=O)(=O)NC1=C(C=C(C=N1)C(F)(F)F)NC(=O)C2=CC3=CC=CC=C3S2 |
| InChIKey | UBEDCGPGVLOYDO-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-. Following Lipinski's Rule of Five, Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)- has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)- is 141284-26-6.
The molecular formula of Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)- is C16H12F3N3O3S2.
The molecular weight of Benzo(b)thiophene-2-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)- is 415.02722 g/mol.
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