2-(4-ethylpiperazin-1-yl)-7-methyl-3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-ethylpiperazin-1-yl)-7-methyl-3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
2-(4-ethylpiperazin-1-yl)-7-methyl-3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0494 |
| Compound Name: | 2-(4-ethylpiperazin-1-yl)-7-methyl-3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C20 H23 N5 O2 S2 |
| Smiles: | CCN1CCN(CC1)C1=C(/C=C2/C(N(C)C(=S)S2)=O)C(N2C=C(C)C=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5552 |
| logD: | 1.125 |
| logSw: | -1.8347 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.329 |
| InChI Key: | YIGSEKVGJRAQBF-UHFFFAOYSA-N |