3-methyl-1-(2-methylphenyl)-4-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
					Chemical Structure Depiction of
3-methyl-1-(2-methylphenyl)-4-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
			3-methyl-1-(2-methylphenyl)-4-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Compound characteristics
| Compound ID: | D361-2468 | 
| Compound Name: | 3-methyl-1-(2-methylphenyl)-4-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one | 
| Molecular Weight: | 349.45 | 
| Molecular Formula: | C20 H19 N3 O S | 
| Smiles: | Cc1ccccc1n1c2c(C(c3ccccc3)SCC(N2)=O)c(C)n1 | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 4.1352 | 
| logD: | 4.135 | 
| logSw: | -4.1471 | 
| Hydrogen bond acceptors count: | 4 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 39.121 | 
| InChI Key: | SZBIAAQYSNFCAF-LJQANCHMSA-N | 
 
				 
				