3-(3,4-dimethoxyphenyl)-7-(3-phenylprop-2-en-1-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-(3-phenylprop-2-en-1-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(3,4-dimethoxyphenyl)-7-(3-phenylprop-2-en-1-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 5521-0049 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-(3-phenylprop-2-en-1-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | COc1ccc(cc1OC)N1CN=C2N(C1)C(/C(=C/C=C/c1ccccc1)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6856 |
| logD: | 4.6854 |
| logSw: | -4.498 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.767 |
| InChI Key: | VKPTYQMFIKFXEJ-UHFFFAOYSA-N |