N-(4-chloro-2-fluorophenyl)-2-[(5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-[(5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-(4-chloro-2-fluorophenyl)-2-[(5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E513-1032 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-[(5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 420.91 |
| Molecular Formula: | C18 H14 Cl F N4 O S2 |
| Smiles: | CCc1nnc(c2cc3c(ccs3)n12)SCC(Nc1ccc(cc1F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3627 |
| logD: | 4.3502 |
| logSw: | -4.464 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.765 |
| InChI Key: | ZDVMEUYYBWUQBC-UHFFFAOYSA-N |