6-tert-butyl-4-{[(4-hydroxy-3-methoxyphenyl)methylidene]amino}-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
6-tert-butyl-4-{[(4-hydroxy-3-methoxyphenyl)methylidene]amino}-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
6-tert-butyl-4-{[(4-hydroxy-3-methoxyphenyl)methylidene]amino}-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | 2595-0270 |
| Compound Name: | 6-tert-butyl-4-{[(4-hydroxy-3-methoxyphenyl)methylidene]amino}-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C16 H20 N4 O3 S |
| Smiles: | CC(C)(C)C1C(N(C(=NN=1)SC)/N=C/c1ccc(c(c1)OC)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5694 |
| logD: | 2.2676 |
| logSw: | -2.6225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.203 |
| InChI Key: | ODHAACMCYRPXDM-UHFFFAOYSA-N |