3-(3-bromophenyl)-7-[(3,4-dimethoxyphenyl)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-[(3,4-dimethoxyphenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(3-bromophenyl)-7-[(3,4-dimethoxyphenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 5521-0008 |
| Compound Name: | 3-(3-bromophenyl)-7-[(3,4-dimethoxyphenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 460.35 |
| Molecular Formula: | C20 H18 Br N3 O3 S |
| Smiles: | COc1ccc(/C=C2/C(N3CN(CN=C3S2)c2cccc(c2)[Br])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.8194 |
| logD: | 4.8074 |
| logSw: | -4.7283 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.767 |
| InChI Key: | LTFXUCQVOXBCIU-UHFFFAOYSA-N |