2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclopentylacetamide
Chemical Structure Depiction of
2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclopentylacetamide
2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclopentylacetamide
Compound characteristics
| Compound ID: | K216-2568 |
| Compound Name: | 2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclopentylacetamide |
| Molecular Weight: | 510.61 |
| Molecular Formula: | C26 H30 N4 O5 S |
| Smiles: | COc1ccc(cc1OC)c1c(c2ccc(c(c2)OC)OC)nnc(n1)SCC(NC1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4951 |
| logD: | 3.4951 |
| logSw: | -3.8611 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.469 |
| InChI Key: | NIORUCCFMZRAPF-UHFFFAOYSA-N |