[(6-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(6-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetic acid
[(6-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | 4896-1500 |
| Compound Name: | [(6-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetic acid |
| Molecular Weight: | 274.3 |
| Molecular Formula: | C12 H10 N4 O2 S |
| Smiles: | Cc1cccc2c3c(nc(nn3)SCC(O)=O)[nH]c12 |
| Stereo: | ACHIRAL |
| logP: | 1.2588 |
| logD: | -2.0337 |
| logSw: | -2.2531 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.96 |
| InChI Key: | ORYGYCLZFDDBDZ-UHFFFAOYSA-N |