2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-ethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Chemical Structure Depiction of
2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-ethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-ethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Compound characteristics
| Compound ID: | E020-0647 |
| Compound Name: | 2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-4-ethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one |
| Molecular Weight: | 346.38 |
| Molecular Formula: | C17 H22 N4 O4 |
| Smiles: | CCC1=NN(CC(N2CCC3(CC2)OCCO3)=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4805 |
| logD: | 0.4805 |
| logSw: | -1.4354 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.22 |
| InChI Key: | SKFSOHVMTQDISM-UHFFFAOYSA-N |