2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
Chemical Structure Depiction of
2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
Compound characteristics
| Compound ID: | C785-0976 |
| Compound Name: | 2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C23 H24 N4 O2 S |
| Smiles: | CCC(C(NC1CCCc2ccccc12)=O)N1C(c2cc3c(ccs3)n2C(C)=N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3779 |
| logD: | 4.3779 |
| logSw: | -4.273 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.041 |
| InChI Key: | SCZLJSDLHOOZAI-UHFFFAOYSA-N |