3-(4-acetylphenyl)-7-[(3-bromophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
3-(4-acetylphenyl)-7-[(3-bromophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(4-acetylphenyl)-7-[(3-bromophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
Compound ID: | 5521-0203 |
Compound Name: | 3-(4-acetylphenyl)-7-[(3-bromophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
Molecular Weight: | 442.33 |
Molecular Formula: | C20 H16 Br N3 O2 S |
Smiles: | CC(c1ccc(cc1)N1CN=C2N(C1)C(/C(=C/c1cccc(c1)[Br])S2)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.929 |
logD: | 4.9032 |
logSw: | -4.6744 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 43.333 |
InChI Key: | COBRGBWDQBFGQI-UHFFFAOYSA-N |