7-[(3-bromophenyl)methylidene]-3-(3,5-dimethylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
7-[(3-bromophenyl)methylidene]-3-(3,5-dimethylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-[(3-bromophenyl)methylidene]-3-(3,5-dimethylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 5521-0222 |
| Compound Name: | 7-[(3-bromophenyl)methylidene]-3-(3,5-dimethylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 428.35 |
| Molecular Formula: | C20 H18 Br N3 O S |
| Smiles: | Cc1cc(C)cc(c1)N1CN=C2N(C1)C(/C(=C/c1cccc(c1)[Br])S2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2175 |
| logD: | 5.8543 |
| logSw: | -5.4923 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5061 |
| InChI Key: | VSMRHPJPGCSFDW-UHFFFAOYSA-N |