N-cyclohexyl-4-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Chemical Structure Depiction of
N-cyclohexyl-4-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
N-cyclohexyl-4-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Compound characteristics
| Compound ID: | C785-4513 |
| Compound Name: | N-cyclohexyl-4-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide |
| Molecular Weight: | 414.57 |
| Molecular Formula: | C22 H30 N4 O2 S |
| Smiles: | CCC1=NN(CCCC(NC2CCCCC2)=O)C(c2cc3c(cc(CC)s3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7628 |
| logD: | 3.7471 |
| logSw: | -3.7789 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.661 |
| InChI Key: | UPFUIHPAXQGRKL-UHFFFAOYSA-N |