5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 8008-5509 |
| Compound Name: | 5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 242.3 |
| Molecular Formula: | C12 H10 N4 S |
| Smiles: | C=CCn1c2ccccc2c2c1nc(nn2)S |
| Stereo: | ACHIRAL |
| logP: | 2.4524 |
| logD: | 1.2274 |
| logSw: | -2.5594 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.105 |
| InChI Key: | DOVCOZLCUCPOIE-UHFFFAOYSA-N |