3-(3-bromophenyl)-7-[(pyridin-3-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
3-(3-bromophenyl)-7-[(pyridin-3-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(3-bromophenyl)-7-[(pyridin-3-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 5521-0012 |
| Compound Name: | 3-(3-bromophenyl)-7-[(pyridin-3-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 401.28 |
| Molecular Formula: | C17 H13 Br N4 O S |
| Smiles: | C1N=C2N(CN1c1cccc(c1)[Br])C(/C(=C/c1cccnc1)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0608 |
| logD: | 4.0487 |
| logSw: | -4.0216 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.024 |
| InChI Key: | DHYGKZCSPAQIPR-UHFFFAOYSA-N |