2-(4-bromophenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-bromophenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-bromophenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0563 |
| Compound Name: | 2-(4-bromophenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 455.37 |
| Molecular Formula: | C21 H19 Br N4 O S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)[Br])n2)S1)=O)\c1ccc(cc1)N(CC)CC |
| Stereo: | ACHIRAL |
| logP: | 5.7357 |
| logD: | 5.7339 |
| logSw: | -5.5709 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.932 |
| InChI Key: | KJEYNDKIWPBOPX-UHFFFAOYSA-N |