6-(2-amino-5-bromophenyl)-3-(hexylsulfanyl)-1,2,4-triazin-5-ol
Chemical Structure Depiction of
6-(2-amino-5-bromophenyl)-3-(hexylsulfanyl)-1,2,4-triazin-5-ol
6-(2-amino-5-bromophenyl)-3-(hexylsulfanyl)-1,2,4-triazin-5-ol
Compound characteristics
| Compound ID: | 4896-5113 |
| Compound Name: | 6-(2-amino-5-bromophenyl)-3-(hexylsulfanyl)-1,2,4-triazin-5-ol |
| Molecular Weight: | 383.31 |
| Molecular Formula: | C15 H19 Br N4 O S |
| Smiles: | CCCCCCSc1nc(c(c2cc(ccc2N)[Br])nn1)O |
| Stereo: | ACHIRAL |
| logP: | 4.5859 |
| logD: | 3.8251 |
| logSw: | -4.4567 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.214 |
| InChI Key: | LIOOYXXJMSCJKL-UHFFFAOYSA-N |