3-[(3-phenylprop-2-en-1-yl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
3-[(3-phenylprop-2-en-1-yl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
3-[(3-phenylprop-2-en-1-yl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
Compound characteristics
| Compound ID: | 8008-8043 |
| Compound Name: | 3-[(3-phenylprop-2-en-1-yl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole |
| Molecular Weight: | 318.4 |
| Molecular Formula: | C18 H14 N4 S |
| Smiles: | C(/C=C/c1ccccc1)Sc1nc2c(c3ccccc3[nH]2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.019 |
| logD: | 4.019 |
| logSw: | -4.4676 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.535 |
| InChI Key: | NYDDQQMNHIWWDH-RMKNXTFCSA-N |