2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-N-[(thiophen-2-yl)methyl]propanamide
Chemical Structure Depiction of
2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-N-[(thiophen-2-yl)methyl]propanamide
2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-N-[(thiophen-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | D699-0138 |
| Compound Name: | 2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-N-[(thiophen-2-yl)methyl]propanamide |
| Molecular Weight: | 431.52 |
| Molecular Formula: | C22 H21 N7 O S |
| Smiles: | CC(C(NCc1cccs1)=O)n1c2ccccc2c2c1nc(nn2)n1c(C)cc(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4479 |
| logD: | 2.4477 |
| logSw: | -2.871 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.454 |
| InChI Key: | GOUUWSSCTPHKEF-HNNXBMFYSA-N |