2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide
Chemical Structure Depiction of
2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide
2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide
Compound characteristics
| Compound ID: | C786-1716 |
| Compound Name: | 2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C20 H26 N4 O2 S |
| Smiles: | CCCSCCCNC(CN1C(c2cc3cc(C)ccc3n2C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8649 |
| logD: | 2.8649 |
| logSw: | -3.2152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.96 |
| InChI Key: | WRLXIGDYOUKPJP-UHFFFAOYSA-N |