7-benzylidene-3-(3-bromophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
7-benzylidene-3-(3-bromophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-benzylidene-3-(3-bromophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 5521-0001 |
| Compound Name: | 7-benzylidene-3-(3-bromophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 400.29 |
| Molecular Formula: | C18 H14 Br N3 O S |
| Smiles: | C1N=C2N(CN1c1cccc(c1)[Br])C(/C(=C/c1ccccc1)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2251 |
| logD: | 5.2131 |
| logSw: | -5.3663 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5061 |
| InChI Key: | MNNFLLZKLWJRQB-UHFFFAOYSA-N |