N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Compound characteristics
Compound ID: | C785-3048 |
Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide |
Molecular Weight: | 482.6 |
Molecular Formula: | C25 H30 N4 O4 S |
Smiles: | CCC1=NN(CC(NCCc2ccc(c(c2)OCC)OCC)=O)C(c2cc3c(cc(C)s3)n12)=O |
Stereo: | ACHIRAL |
logP: | 3.0053 |
logD: | 3.0053 |
logSw: | -3.2411 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.219 |
InChI Key: | VZUDBVZDSNISGK-UHFFFAOYSA-N |