4-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(3-phenylpropyl)butanamide
Chemical Structure Depiction of
4-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(3-phenylpropyl)butanamide
4-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(3-phenylpropyl)butanamide
Compound characteristics
| Compound ID: | C887-2972 |
| Compound Name: | 4-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(3-phenylpropyl)butanamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | C(Cc1ccccc1)CNC(CCCN1C(c2cc3c(cco3)n2C=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6469 |
| logD: | 1.6464 |
| logSw: | -2.08 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.447 |
| InChI Key: | KMDGEIDYQZFYQU-UHFFFAOYSA-N |