N-(2,5-dimethylphenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide
N-(2,5-dimethylphenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | D243-0472 |
| Compound Name: | N-(2,5-dimethylphenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C20 H22 N4 O2 S |
| Smiles: | CC(C(Nc1cc(C)ccc1C)=O)N1C(c2c3CCCCc3sc2N=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2792 |
| logD: | 4.2792 |
| logSw: | -4.3823 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.954 |
| InChI Key: | VQQNCTOGNIPIPC-ZDUSSCGKSA-N |