N-[(4-chlorophenyl)methyl]-4-(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-[(4-chlorophenyl)methyl]-4-(5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
N-[(4-chlorophenyl)methyl]-4-(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: | C784-3233 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4-(5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide |
| Molecular Weight: | 426.9 |
| Molecular Formula: | C22 H23 Cl N4 O3 |
| Smiles: | CCC1=NN(CCCC(NCc2ccc(cc2)[Cl])=O)C(c2cc3c(cc(C)o3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0231 |
| logD: | 3.0074 |
| logSw: | -3.4872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.903 |
| InChI Key: | GAWCRKVJPIRKLL-UHFFFAOYSA-N |