2-[3-tert-butyl-4-(2-chlorophenyl)-1-(3-fluorophenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide
					Chemical Structure Depiction of
2-[3-tert-butyl-4-(2-chlorophenyl)-1-(3-fluorophenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide
			2-[3-tert-butyl-4-(2-chlorophenyl)-1-(3-fluorophenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide
Compound characteristics
| Compound ID: | V030-7783 | 
| Compound Name: | 2-[3-tert-butyl-4-(2-chlorophenyl)-1-(3-fluorophenyl)-7-oxo-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide | 
| Molecular Weight: | 545.08 | 
| Molecular Formula: | C27 H30 Cl F N4 O3 S | 
| Salt: | not_available | 
| Smiles: | CC(C)(C)c1c2C(c3ccccc3[Cl])SCC(N(CC(NCCOC)=O)c2n(c2cccc(c2)F)n1)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 5.0703 | 
| logD: | 5.0703 | 
| logSw: | -5.3442 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 63.223 | 
| InChI Key: | QARXSRUHBYFFPZ-XMMPIXPASA-N | 
 
				 
				