N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dimethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dimethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dimethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Compound characteristics
| Compound ID: | C784-2974 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dimethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide |
| Molecular Weight: | 422.44 |
| Molecular Formula: | C22 H22 N4 O5 |
| Smiles: | CC1=NN(CCCC(NCc2ccc3c(c2)OCO3)=O)C(c2cc3c(cc(C)o3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0049 |
| logD: | 1.9983 |
| logSw: | -2.5475 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.927 |
| InChI Key: | RIFVRYKPBOBHSO-UHFFFAOYSA-N |