1-[3-(methylsulfanyl)-6-(thiophen-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethan-1-one
					Chemical Structure Depiction of
1-[3-(methylsulfanyl)-6-(thiophen-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethan-1-one
			1-[3-(methylsulfanyl)-6-(thiophen-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | 4896-0286 | 
| Compound Name: | 1-[3-(methylsulfanyl)-6-(thiophen-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethan-1-one | 
| Molecular Weight: | 370.45 | 
| Molecular Formula: | C17 H14 N4 O2 S2 | 
| Smiles: | CC(N1C(c2cccs2)Oc2c(c3ccccc13)nnc(n2)SC)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 2.7804 | 
| logD: | 2.7804 | 
| logSw: | -3.4816 | 
| Hydrogen bond acceptors count: | 7 | 
| Polar surface area: | 55.657 | 
| InChI Key: | HHVGNFDQCRPCOP-INIZCTEOSA-N | 
 
				 
				