2-[3-tert-butyl-4-(2,4-difluorophenyl)-1-(4-methylphenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methylpropyl)acetamide
					Chemical Structure Depiction of
2-[3-tert-butyl-4-(2,4-difluorophenyl)-1-(4-methylphenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methylpropyl)acetamide
			2-[3-tert-butyl-4-(2,4-difluorophenyl)-1-(4-methylphenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methylpropyl)acetamide
Compound characteristics
| Compound ID: | V020-7815 | 
| Compound Name: | 2-[3-tert-butyl-4-(2,4-difluorophenyl)-1-(4-methylphenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methylpropyl)acetamide | 
| Molecular Weight: | 540.68 | 
| Molecular Formula: | C29 H34 F2 N4 O2 S | 
| Smiles: | CC(C)CNC(CN1C(CSC(c2ccc(cc2F)F)c2c(C(C)(C)C)nn(c3ccc(C)cc3)c12)=O)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 6.2855 | 
| logD: | 6.2855 | 
| logSw: | -5.3696 | 
| Hydrogen bond acceptors count: | 6 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 55.039 | 
| InChI Key: | WIBSJPKSFHVGDX-AREMUKBSSA-N | 
 
				 
				