2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C785-1924 |
| Compound Name: | 2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 402.52 |
| Molecular Formula: | C19 H26 N6 O2 S |
| Smiles: | CCC1=NN(CC(NCCN2CCN(C)CC2)=O)C(c2cc3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4589 |
| logD: | -0.2086 |
| logSw: | -2.3406 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.258 |
| InChI Key: | UQVWCZSLNUQKTO-UHFFFAOYSA-N |