7-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-3-(4-fluorophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
7-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-3-(4-fluorophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-3-(4-fluorophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | Y505-3052 |
| Compound Name: | 7-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-3-(4-fluorophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C17 H16 F N5 O S |
| Smiles: | Cc1c(/C=C2/C(N3CN(CN=C3S2)c2ccc(cc2)F)=O)cnn1C |
| Stereo: | ACHIRAL |
| logP: | 3.121 |
| logD: | 3.0952 |
| logSw: | -3.0886 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.993 |
| InChI Key: | POWOJBIHFHALRV-CHHVJCJISA-N |