7-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
7-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
7-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C785-1996 |
| Compound Name: | 7-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-ethylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 434.56 |
| Molecular Formula: | C24 H26 N4 O2 S |
| Smiles: | CCC1=NN(CC(N2CCC(CC2)Cc2ccccc2)=O)C(c2cc3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9748 |
| logD: | 3.9748 |
| logSw: | -4.0838 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.607 |
| InChI Key: | KUHAYCJKPRDWKM-UHFFFAOYSA-N |