3-(1-oxo-1-phenylpropan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
3-(1-oxo-1-phenylpropan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
3-(1-oxo-1-phenylpropan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D243-0378 |
| Compound Name: | 3-(1-oxo-1-phenylpropan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C18 H17 N3 O2 S |
| Smiles: | CC(C(c1ccccc1)=O)N1C(c2c3CCCCc3sc2N=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2156 |
| logD: | 4.2156 |
| logSw: | -4.4295 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.027 |
| InChI Key: | CNSCDIRVNWLAAJ-NSHDSACASA-N |