N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Compound characteristics
| Compound ID: | C784-1777 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide |
| Molecular Weight: | 466.54 |
| Molecular Formula: | C25 H30 N4 O5 |
| Smiles: | CCC(C(NCCc1ccc(c(c1)OC)OC)=O)N1C(c2cc3c(cc(C)o3)n2C(CC)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2117 |
| logD: | 3.2116 |
| logSw: | -3.2381 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.358 |
| InChI Key: | NXQXLOAVUITAIK-KRWDZBQOSA-N |