2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide
2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C785-3123 |
| Compound Name: | 2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | CCC1=NN(CC(NCc2ccccc2C)=O)C(c2cc3c(cc(C)s3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1102 |
| logD: | 4.1102 |
| logSw: | -4.1133 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.958 |
| InChI Key: | PNGDDIFJGLHEJE-UHFFFAOYSA-N |