3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
Compound characteristics
| Compound ID: | 8012-9260 |
| Compound Name: | 3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole |
| Molecular Weight: | 344.8 |
| Molecular Formula: | C16 H10 Cl F N4 S |
| Smiles: | C(c1ccc(cc1[Cl])F)Sc1nc2c(c3ccccc3[nH]2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2011 |
| logD: | 4.2011 |
| logSw: | -4.4088 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.535 |
| InChI Key: | OYRRJSJCOJWPDS-UHFFFAOYSA-N |