6-ethyl-6-methyl-11-(2-methylprop-2-en-1-yl)-9-(propylsulfanyl)-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Chemical Structure Depiction of
6-ethyl-6-methyl-11-(2-methylprop-2-en-1-yl)-9-(propylsulfanyl)-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
6-ethyl-6-methyl-11-(2-methylprop-2-en-1-yl)-9-(propylsulfanyl)-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Compound characteristics
| Compound ID: | D461-0426 |
| Compound Name: | 6-ethyl-6-methyl-11-(2-methylprop-2-en-1-yl)-9-(propylsulfanyl)-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one |
| Molecular Weight: | 408.56 |
| Molecular Formula: | C23 H28 N4 O S |
| Smiles: | CCCSC1=NN(CC(C)=C)C2=NC3=C(C(N12)=O)C(C)(CC)Cc1ccccc13 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4669 |
| logD: | 5.4642 |
| logSw: | -5.4582 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.84 |
| InChI Key: | NGRCRLSZGKHVGL-QHCPKHFHSA-N |