7-[(3-nitrophenyl)methylidene]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
7-[(3-nitrophenyl)methylidene]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-[(3-nitrophenyl)methylidene]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 4268-0218 |
| Compound Name: | 7-[(3-nitrophenyl)methylidene]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 434.39 |
| Molecular Formula: | C19 H13 F3 N4 O3 S |
| Smiles: | C1N=C2N(CN1c1cccc(c1)C(F)(F)F)C(/C(=C/c1cccc(c1)[N+]([O-])=O)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0922 |
| logD: | 4.984 |
| logSw: | -5.3555 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.888 |
| InChI Key: | RXRHBTCCSHZCMS-UHFFFAOYSA-N |