N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)propanamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)propanamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)propanamide
Compound characteristics
| Compound ID: | C785-1309 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)propanamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C24 H28 N4 O4 S |
| Smiles: | CCOc1ccc(CCNC(C(C)N2C(c3cc4c(ccs4)n3C(C)=N2)=O)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6881 |
| logD: | 2.6881 |
| logSw: | -2.9921 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.874 |
| InChI Key: | JALYPWCPSKUZSF-HNNXBMFYSA-N |