4-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1-phenylethyl)butanamide
Chemical Structure Depiction of
4-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1-phenylethyl)butanamide
4-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1-phenylethyl)butanamide
Compound characteristics
| Compound ID: | C785-2686 |
| Compound Name: | 4-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-(1-phenylethyl)butanamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | CC(c1ccccc1)NC(CCCN1C(c2cc3c(ccs3)n2C(C)=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.528 |
| logD: | 2.5266 |
| logSw: | -2.8704 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.007 |
| InChI Key: | CHHFCLMVOPEUHM-AWEZNQCLSA-N |