6-(4-ethoxyphenyl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Chemical Structure Depiction of
6-(4-ethoxyphenyl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
6-(4-ethoxyphenyl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Compound characteristics
Compound ID: | 8007-7243 |
Compound Name: | 6-(4-ethoxyphenyl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine |
Molecular Weight: | 394.49 |
Molecular Formula: | C21 H22 N4 O2 S |
Smiles: | CCCSc1nc2c(c3ccccc3NC(c3ccc(cc3)OCC)O2)nn1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7315 |
logD: | 4.7315 |
logSw: | -4.4961 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.421 |
InChI Key: | UDPHARPPLOEEPT-IBGZPJMESA-N |