3-[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
3-[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
3-[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | D358-0559 |
| Compound Name: | 3-[4-(3-phenylprop-2-en-1-yl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 434.56 |
| Molecular Formula: | C24 H26 N4 O2 S |
| Smiles: | C1CCC2=C(C1)N1C(=NC=C(C(N3CCN(CC3)C/C=C/c3ccccc3)=O)C1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 2.6369 |
| logD: | 2.6346 |
| logSw: | -2.8193 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.791 |
| InChI Key: | LCBJRNDCAIRSOT-UHFFFAOYSA-N |