N-(3-chloro-4-methoxyphenyl)-4-(5-ethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-(5-ethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
N-(3-chloro-4-methoxyphenyl)-4-(5-ethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Compound characteristics
| Compound ID: | C887-1621 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-4-(5-ethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C21 H21 Cl N4 O4 |
| Smiles: | CCC1=NN(CCCC(Nc2ccc(c(c2)[Cl])OC)=O)C(c2cc3c(cco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6935 |
| logD: | 2.6896 |
| logSw: | -3.4554 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.698 |
| InChI Key: | KLISKOXINWLFIM-UHFFFAOYSA-N |