(7Z)-3-(4-chlorophenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
(7Z)-3-(4-chlorophenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
(7Z)-3-(4-chlorophenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | IB03-0624 |
| Compound Name: | (7Z)-3-(4-chlorophenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 400.84 |
| Molecular Formula: | C18 H13 Cl N4 O3 S |
| Smiles: | C1N=C2N(CN1c1ccc(cc1)[Cl])C(/C(=C/c1cccc(c1)[N+]([O-])=O)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.01 |
| logD: | 5 |
| logSw: | -5.74 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 180.25 |
| InChI Key: | XECZLFFBWOEXFG-UHFFFAOYSA-N |