TL;DR: N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide (CAS 606131-37-7) is a chemical compound with molecular formula C19H16F3N3OS and molecular weight 391.09662 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide
Also Known As: ACETAMIDE,N,N-DIMETHYL-2-[[2-PHENYL-8-(TRIFLUOROMETHYL)-4-QUINAZOLINYL]THIO]-, N,N-Dimethyl-2-[[2-Phenyl-8-(Trifluoromethyl)-4-Quinazolinyl]Thio]-Acetamide, Acetamide, N,N-dimethyl-2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]- (9CI), N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide, N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide
| Molecular Formula | C19H16F3N3OS |
| Molecular Weight | 391.09662 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 71.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.09662 Da |
| Heavy Atoms | 27 |
| Complexity | 511.0 |
| SMILES | CN(C)C(=O)CSC1=NC(=NC2=C1C=CC=C2C(F)(F)F)C3=CC=CC=C3 |
| InChIKey | KPKAEDRUZJVVEJ-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide. Following Lipinski's Rule of Five, N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide is 606131-37-7.
The molecular formula of N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide is C19H16F3N3OS.
The molecular weight of N,N-dimethyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide is 391.09662 g/mol.
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