2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K216-2546 |
| Compound Name: | 2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 606.7 |
| Molecular Formula: | C31 H34 N4 O7 S |
| Smiles: | COc1ccc(CCNC(CSc2nc(c3ccc(c(c3)OC)OC)c(c3ccc(c(c3)OC)OC)nn2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0276 |
| logD: | 3.0276 |
| logSw: | -3.3856 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.481 |
| InChI Key: | GUHFYQZZXJPLLK-UHFFFAOYSA-N |